ASN 13778702
TL;DR: ASN 13778702 (CAS 879596-65-3) is a chemical compound with molecular formula C16H18N4O3S2 and molecular weight 378.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-(2-methoxyethylsulfanyl)-1,3,4-thiadiazol-2-yl]-5-oxo-1-phenylpyrrolidine-3-carboxamide
Also Known As: ASN 13778702, N-{5-[(2-methoxyethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-5-oxo-1-phenylpyrrolidine-3-carboxamide, N-[5-(2-methoxyethylsulfanyl)-1,3,4-thiadiazol-2-yl]-5-oxo-1-phenylpyrrolidine-3-carboxamide, N-[5-(2-methoxyethylthio)(1,3,4-thiadiazol-2-yl)](5-oxo-1-phenylpyrrolidin-3-y l)carboxamide
| Molecular Formula | C16H18N4O3S2 |
|---|---|
| Molecular Weight | 378.08 g/mol |
| LogP | 2.2682 |
| Topological Polar Surface Area | 84.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 378.08203 |
| Heavy Atoms | 25 |
| Complexity | 737.9909 |
Chemical Identifiers
| CAS Number | 879596-65-3 |
|---|---|
| SMILES | COCCSC1=NN=C(S1)NC(=O)C2CC(=O)N(C2)C3=CC=CC=C3 |
Product Overview
ASN 13778702 (CAS 879596-65-3), with molecular formula C16H18N4O3S2 and molecular weight 378.08 g/mol. IUPAC: N-[5-(2-methoxyethylsulfanyl)-1,3,4-thiadiazol-2-yl]-5-oxo-1-phenylpyrrolidine-3-carboxamide.
Chemical Property Profile of ASN 13778702
Property Insights of ASN 13778702
The XLogP value of 2.2682 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ASN 13778702. The TPSA of 84.42 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 13778702. Following Lipinski's Rule of Five, ASN 13778702 has 1 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 ASN 13778702?
The CAS number of ASN 13778702 is 879596-65-3.
What is the molecular formula of ASN 13778702?
The molecular formula of ASN 13778702 is C16H18N4O3S2.
What is the molecular weight of ASN 13778702?
The molecular weight of ASN 13778702 is 378.08 g/mol.
Where can I buy ASN 13778702?
You can request a quote for ASN 13778702 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 13778702?
Yes, KEHONG BIO provides custom synthesis services for ASN 13778702 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.