ASN 13779463
TL;DR: ASN 13779463 (CAS 887674-68-2) is a chemical compound with molecular formula C18H18ClN3O2 and molecular weight 343.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-chloro-4-methylphenyl)-5-oxo-N-(pyridin-3-ylmethyl)pyrrolidine-3-carboxamide
Also Known As: ASN 13779463, 1-(3-chloro-4-methylphenyl)-5-oxo-N-(pyridin-3-ylmethyl)pyrrolidine-3-carboxamide, [1-(3-chloro-4-methylphenyl)-5-oxopyrrolidin-3-yl]-N-(3-pyridylmethyl)carboxam ide, 1-(3-CHLORO-4-METHYLPHENYL)-5-OXO-N-[(PYRIDIN-3-YL)METHYL]PYRROLIDINE-3-CARBOXAMIDE
| Molecular Formula | C18H18ClN3O2 |
|---|---|
| Molecular Weight | 343.11 g/mol |
| LogP | 2.71272 |
| Topological Polar Surface Area | 62.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 343.10876 |
| Heavy Atoms | 24 |
| Complexity | 764.11414 |
Chemical Identifiers
| CAS Number | 887674-68-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N2CC(CC2=O)C(=O)NCC3=CN=CC=C3)Cl |
Product Overview
ASN 13779463 (CAS 887674-68-2), with molecular formula C18H18ClN3O2 and molecular weight 343.11 g/mol. IUPAC: 1-(3-chloro-4-methylphenyl)-5-oxo-N-(pyridin-3-ylmethyl)pyrrolidine-3-carboxamide.
Chemical Property Profile of ASN 13779463
Property Insights of ASN 13779463
The XLogP value of 2.71272 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ASN 13779463. The TPSA of 62.3 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 13779463. Following Lipinski's Rule of Five, ASN 13779463 has 1 hydrogen bond donor(s) and 3 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 ASN 13779463?
The CAS number of ASN 13779463 is 887674-68-2.
What is the molecular formula of ASN 13779463?
The molecular formula of ASN 13779463 is C18H18ClN3O2.
What is the molecular weight of ASN 13779463?
The molecular weight of ASN 13779463 is 343.11 g/mol.
Where can I buy ASN 13779463?
You can request a quote for ASN 13779463 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 13779463?
Yes, KEHONG BIO provides custom synthesis services for ASN 13779463 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.