ASN 13779580
TL;DR: ASN 13779580 (CAS 887675-09-4) is a chemical compound with molecular formula C14H13ClN4O2S and molecular weight 336.04 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-(1,3,4-thiadiazol-2-yl)pyrrolidine-3-carboxamide
Also Known As: ASN 13779580, 1-(3-chloro-4-methylphenyl)-5-oxo-N-(1,3,4-thiadiazol-2-yl)pyrrolidine-3-carboxamide, [1-(3-chloro-4-methylphenyl)-5-oxopyrrolidin-3-yl]-N-(1,3,4-thiadiazol-2-yl)ca rboxamide
| Molecular Formula | C14H13ClN4O2S |
|---|---|
| Molecular Weight | 336.04 g/mol |
| LogP | 2.49152 |
| Topological Polar Surface Area | 75.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 336.04477 |
| Heavy Atoms | 22 |
| Complexity | 719.6378 |
Chemical Identifiers
| CAS Number | 887675-09-4 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N2CC(CC2=O)C(=O)NC3=NN=CS3)Cl |
Product Overview
ASN 13779580 (CAS 887675-09-4), with molecular formula C14H13ClN4O2S and molecular weight 336.04 g/mol. IUPAC: 1-(3-chloro-4-methylphenyl)-5-oxo-N-(1,3,4-thiadiazol-2-yl)pyrrolidine-3-carboxamide.
Chemical Property Profile of ASN 13779580
Property Insights of ASN 13779580
The XLogP value of 2.49152 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ASN 13779580. The TPSA of 75.19 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 13779580. Following Lipinski's Rule of Five, ASN 13779580 has 1 hydrogen bond donor(s) and 5 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 13779580?
The CAS number of ASN 13779580 is 887675-09-4.
What is the molecular formula of ASN 13779580?
The molecular formula of ASN 13779580 is C14H13ClN4O2S.
What is the molecular weight of ASN 13779580?
The molecular weight of ASN 13779580 is 336.04 g/mol.
Where can I buy ASN 13779580?
You can request a quote for ASN 13779580 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 13779580?
Yes, KEHONG BIO provides custom synthesis services for ASN 13779580 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.