CAS RN: 190910-14-6
DMBAP
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260411 | 5mg / 25mg | Confirm by inquiry | Shanghai | Inquiry |
- Product code: starshine_CAS190910-14-6
- Purity/Analytical Methods: >99.0%
190910-14-6 / (3S)-4-[[(1S)-1-carboxy-2-phenylethyl]amino]-3-(3,3-dimethylbutylamino)-4-oxobutanoic acid
Basic Information
CAS
190910-14-6
Multi CAS
No
Molecular Formula
C19H28N2O5
Molecular Weight
364.400000
Exact Mass
364.199822
SMILES
CC(C)(C)CCN[C@@H](CC(=O)O)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O
InChI
InChI=1S/C19H28N2O5/c1-19(2,3)9-10-20-14(12-16(22)23)17(24)21-15(18(25)26)11-13-7-5-4-6-8-13/h4-8,14-15,20H,9-12H2,1-3H3,(H,21,24)(H,22,23)(H,25,26)/t14-,15-/m0/s1
InChIKey
YHHAZJVJJCTGLB-GJZGRUSLSA-N
Computed Properties
Structural Parameters
Heavy atom count
26
Aromatic heavy atom count
6
Fraction Csp3
0.53
Rotatable bonds
10
H-bond acceptors
4
H-bond donors
4
Molar refractivity
97.83
TPSA
115.73
LogP / Solubility
WLOGP
1.67
MLOGP
1.49
XLogP3
0.1
Consensus LogP
1.09
Log S (ESOL)
-2.66
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.75
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.61
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.76
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5
Customers Also Viewed
-
-
4H-Pyran-4-one,2,3-dihydro-2-methyl-,(2R)-(9CI)
- CAS RN: 190912-17-5
- Product Code: SSC-089345
-
(R)-4-(hydroxyMethyl)-1-((R)-1-phenylethyl)pyrrolidin-2-one
- CAS RN: 190957-22-3
- Product Code: SSC-089507
-
Furo[3,2-c]pyridine-4-carbonitrile(9CI)
- CAS RN: 190957-76-7
- Product Code: starshine_CAS190957-76-7
- Purity/Analytical method: >99.0%
-
Furo[2,3-c]pyridine-7-carboxylic acid (9CI)
- CAS RN: 190957-81-4
- Product Code: starshine_CAS190957-81-4
- Purity/Analytical method: >99.0%
-
![CAS 190957-76-7 Furo[3,2-c]pyridine-4-carbonitrile(9CI) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/190957-76-7.gif)
![CAS 190957-81-4 Furo[2,3-c]pyridine-7-carboxylic acid (9CI) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/190957-81-4.gif)
![CAS 190957-82-5 Furo[3,2-c]pyridine-4-carboxylic acid (9CI) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/190957-82-5.gif)