![CAS 2603528-97-6 2-Pyrrolidinecarboxamide, 1-[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridinyl]-3-hydroxy-N-methyl-N-(3-methylphenyl)-, (2S,3R)- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2603528-97-6.gif)
CAS RN: 2603528-97-6
2-Pyrrolidinecarboxamide, 1-[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridinyl]-3-hydroxy-N-methyl-N-(3-methylphenyl)-, (2S,3R)-
Product Availability
Choose a grade to view its available package options.
7 package records6 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260326 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20260407 | 10mg | In stock | Shanghai | Inquiry | |
| Batchno.20250605 | 1mg | In stock | Shanghai | Inquiry | |
| Batchno.20251230 | 25mg | In stock | Shanghai | Inquiry | |
| Batchno.20250417 | 50mg | In stock | Shanghai | Inquiry | |
| Batchno.20260531 | 5mg | In stock | Shanghai | Inquiry | |
| Batchno.20260526 | 5mg / 10mg | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-122857
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: 0.1g
- 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 |
|---|---|---|---|---|
| 0.1g | ≥95% | 0 Out of Stock | Hong Kong | Inquiry |
2603528-97-6 / (2S,3R)-1-[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridinyl]-3-hydroxy-N-methyl-N-(3-methylphenyl)pyrrolidine-2-carboxamide
Basic Information
CAS
2603528-97-6
Multi CAS
No
Molecular Formula
C21H21F3N4O2
Molecular Weight
418.400000
Exact Mass
418.161660
SMILES
CC1=CC(=CC=C1)N(C)C(=O)[C@@H]2[C@@H](CCN2C3=NC(=CC(=C3C#N)C(F)(F)F)C)O
InChI
InChI=1S/C21H21F3N4O2/c1-12-5-4-6-14(9-12)27(3)20(30)18-17(29)7-8-28(18)19-15(11-25)16(21(22,23)24)10-13(2)26-19/h4-6,9-10,17-18,29H,7-8H2,1-3H3/t17-,18+/m1/s1
InChIKey
YHMDHAMZFMNMTF-MSOLQXFVSA-N
Computed Properties
Structural Parameters
Heavy atom count
30
Aromatic heavy atom count
12
Fraction Csp3
0.38
Rotatable bonds
3
H-bond acceptors
5
H-bond donors
1
Molar refractivity
105.04
TPSA
80.46
LogP / Solubility
WLOGP
3.19
MLOGP
2.83
XLogP3
3.9
Consensus LogP
3.31
Log S (ESOL)
-4.54
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.3
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.39
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.01
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
-
2,6(1H)-Isoquinolinedicarboxylic acid, 5-chloro-3,4-dihydro-, 2-(1,1-dimethylethyl) ester
- CAS RN: 2605229-68-1
- Product Code: SSC-122895
-
4-Pentenoic acid, 2-[[(9H-fluoren-9-ylmethoxy)carbonyl]methylamino]-, (2S)-
- CAS RN: 2606012-88-6
- Product Code: SSC-122907
-
INDEX NAME NOT YET ASSIGNED
- CAS RN: 2607105-89-3
- Product Code: starshine_CAS2607105-89-3
- Purity/Analytical method: >99.0%
-
tert-Butyl 4-hydrazinylpiperidine-1-carboxylate 4-methylbenzenesulfonate
- CAS RN: 2609842-67-1
- Product Code: SSC-122970
-
-
3-Pyridinecarbonitrile, 6-(dimethylphosphinyl)-
- CAS RN: 2613384-19-1
- Product Code: starshine_CAS2613384-19-1
- Purity/Analytical method: >99.0%
![CAS 2606012-88-6 4-Pentenoic acid, 2-[[(9H-fluoren-9-ylmethoxy)carbonyl]methylamino]-, (2S)- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2606012-88-6.gif)
