UPCMLD0ENAT0506-1195:001
TL;DR: UPCMLD0ENAT0506-1195:001 (CAS 379701-41-4) is a chemical compound with molecular formula C21H20N4O4S and molecular weight 424.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(2-amino-2-oxoethyl)sulfanyl-5-cyano-4-(furan-3-yl)-N-(2-methoxyphenyl)-2-methyl-1,4-dihydropyridine-3-carboxamide
Also Known As: UPCMLD0ENAT0506-1195:001, 6-[(carbamoylmethyl)sulfanyl]-5-cyano-4-(furan-3-yl)-N-(2-methoxyphenyl)-2-methyl-1,4-dihydropyridine-3-carboxamide, A2512/0106696, F0894-0069, 6-((2-amino-2-oxoethyl)thio)-5-cyano-4-(furan-3-yl)-N-(2-methoxyphenyl)-2-methyl-1,4-dihydropyridine-3-carboxamide
| Molecular Formula | C21H20N4O4S |
|---|---|
| Molecular Weight | 424.12 g/mol |
| LogP | 2.84138 |
| Topological Polar Surface Area | 130.38 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 424.1205 |
| Heavy Atoms | 30 |
| Complexity | 1066.9255 |
Chemical Identifiers
| CAS Number | 379701-41-4 |
|---|---|
| SMILES | CC1=C(C(C(=C(N1)SCC(=O)N)C#N)C2=COC=C2)C(=O)NC3=CC=CC=C3OC |
Product Overview
UPCMLD0ENAT0506-1195:001 (CAS 379701-41-4), with molecular formula C21H20N4O4S and molecular weight 424.12 g/mol. IUPAC: 6-(2-amino-2-oxoethyl)sulfanyl-5-cyano-4-(furan-3-yl)-N-(2-methoxyphenyl)-2-methyl-1,4-dihydropyridine-3-carboxamide.
Chemical Property Profile of UPCMLD0ENAT0506-1195:001
Property Insights of UPCMLD0ENAT0506-1195:001
The XLogP value of 2.84138 suggests moderate lipophilicity, balancing water solubility and membrane permeability for UPCMLD0ENAT0506-1195:001. The TPSA of 130.38 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT0506-1195:001. Following Lipinski's Rule of Five, UPCMLD0ENAT0506-1195:001 has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of UPCMLD0ENAT0506-1195:001?
The CAS number of UPCMLD0ENAT0506-1195:001 is 379701-41-4.
What is the molecular formula of UPCMLD0ENAT0506-1195:001?
The molecular formula of UPCMLD0ENAT0506-1195:001 is C21H20N4O4S.
What is the molecular weight of UPCMLD0ENAT0506-1195:001?
The molecular weight of UPCMLD0ENAT0506-1195:001 is 424.12 g/mol.
Where can I buy UPCMLD0ENAT0506-1195:001?
You can request a quote for UPCMLD0ENAT0506-1195:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT0506-1195:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT0506-1195:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.