![CAS 2172819-72-4 L-Prolinamide, N-(3-carboxy-1-oxopropyl)-3-methyl-L-valyl-4-hydroxy-N-[[4-(4-methyl-5-thiazolyl)phenyl]methyl]-, (4R)- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2172819-72-4.png)
CAS RN: 2172819-72-4
L-Prolinamide, N-(3-carboxy-1-oxopropyl)-3-methyl-L-valyl-4-hydroxy-N-[[4-(4-methyl-5-thiazolyl)phenyl]methyl]-, (4R)-
Product Availability
Choose a grade to view its available package options.
9 package records8 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20251031 | 100mg | In stock | Shanghai, Shenzhen, Wuhan | Inquiry | |
| Batchno.20260324 | 100mg / 250mg | Out of stock | 5-7 business days | Inquiry | |
| Batchno.20250625 | 1g | In stock | Shanghai, Tianjin | Inquiry | |
| Batchno.20251016 | 250mg | In stock | Shanghai, Tianjin, Wuhan | Inquiry | |
| Batchno.20250605 | 50mg | In stock | Shanghai, Shenzhen | Inquiry |
- Product code: SSC-104775
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 0.25g
- Available purity: ≥95%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 0.25g | ≥95% | 0 Out of Stock | Hong Kong | Inquiry |
2172819-72-4 / 4-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methylcarbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-4-oxobutanoic acid
Basic Information
CAS
2172819-72-4
Multi CAS
No
Molecular Formula
C26H34N4O6S
Molecular Weight
530.600000
Exact Mass
530.219906
SMILES
CC1=C(SC=N1)C2=CC=C(C=C2)CNC(=O)[C@@H]3C[C@H](CN3C(=O)[C@H](C(C)(C)C)NC(=O)CCC(=O)O)O
InChI
InChI=1S/C26H34N4O6S/c1-15-22(37-14-28-15)17-7-5-16(6-8-17)12-27-24(35)19-11-18(31)13-30(19)25(36)23(26(2,3)4)29-20(32)9-10-21(33)34/h5-8,14,18-19,23,31H,9-13H2,1-4H3,(H,27,35)(H,29,32)(H,33,34)/t18-,19+,23-/m1/s1
InChIKey
MIVGLJJVHAUZOZ-SELNLUPBSA-N
Computed Properties
Structural Parameters
Heavy atom count
37
Aromatic heavy atom count
11
Fraction Csp3
0.5
Rotatable bonds
9
H-bond acceptors
7
H-bond donors
4
Molar refractivity
138.51
TPSA
148.93
LogP / Solubility
WLOGP
2.09
MLOGP
1.88
XLogP3
1.7
Consensus LogP
1.89
Log S (ESOL)
-4.07
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.42
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.93
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.47
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
5.5
Customers Also Viewed
-
![CAS 2172819-73-5 L-Prolinamide, N-(4-carboxy-1-oxobutyl)-3-methyl-L-valyl-4-hydroxy-N-[[4-(4-methyl-5-thiazolyl)phenyl]methyl]-, (4R)- molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
L-Prolinamide, N-(4-carboxy-1-oxobutyl)-3-methyl-L-valyl-4-hydroxy-N-[[4-(4-methyl-5-thiazolyl)phenyl]methyl]-, (4R)-
- CAS RN: 2172819-73-5
- Product Code: SSC-104776
-
6-(((S)-1-((2S,4R)-4-hydroxy-2-((4-(4-methylthiazol-5-yl)benzyl)carbamoyl)pyrrolidin-1-yl)-3,3-dimethyl-1-oxobutan-2-yl)amino)-6-oxohexanoic acid
- CAS RN: 2172819-74-6
- Product Code: SSC-104777
-
rac-8-(((R)-1-((2R,4S)-4-hydroxy-2-((4-(4-methylthiazol-5-yl)benzyl)carbamoyl)pyrrolidin-1-yl)-3,3-dimethyl-1-oxobutan-2-yl)amino)-8-oxooctanoic acid
- CAS RN: 2172819-75-7
- Product Code: SSC-104778
-
-
-
(6-METHOXYPYRIDIN-2-YL)METHANAMINE DIHYDROCHLORIDE
- CAS RN: 2172852-89-8
- Product Code: SSC-104787
![CAS 2172819-73-5 L-Prolinamide, N-(4-carboxy-1-oxobutyl)-3-methyl-L-valyl-4-hydroxy-N-[[4-(4-methyl-5-thiazolyl)phenyl]methyl]-, (4R)- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2172819-73-5.png)
