BAS 13313201
TL;DR: BAS 13313201 (CAS 878431-85-7) is a chemical compound with molecular formula C17H20N4O2S and molecular weight 344.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,3-dimethylphenyl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-oxopyrrolidine-3-carboxamide
Also Known As: BAS 13313201, 1-(2,3-dimethylphenyl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-oxopyrrolidine-3-carboxamide, [1-(2,3-dimethylphenyl)-5-oxopyrrolidin-3-yl]-N-(5-ethyl(1,3,4-thiadiazol-2-yl ))carboxamide
| Molecular Formula | C17H20N4O2S |
|---|---|
| Molecular Weight | 344.13 g/mol |
| LogP | 2.70894 |
| Topological Polar Surface Area | 75.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 344.1307 |
| Heavy Atoms | 24 |
| Complexity | 786.64777 |
Chemical Identifiers
| CAS Number | 878431-85-7 |
|---|---|
| SMILES | CCC1=NN=C(S1)NC(=O)C2CC(=O)N(C2)C3=CC=CC(=C3C)C |
Product Overview
BAS 13313201 (CAS 878431-85-7), with molecular formula C17H20N4O2S and molecular weight 344.13 g/mol. IUPAC: 1-(2,3-dimethylphenyl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-oxopyrrolidine-3-carboxamide.
Chemical Property Profile of BAS 13313201
Property Insights of BAS 13313201
The XLogP value of 2.70894 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 13313201. The TPSA of 75.19 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 13313201. Following Lipinski's Rule of Five, BAS 13313201 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 BAS 13313201?
The CAS number of BAS 13313201 is 878431-85-7.
What is the molecular formula of BAS 13313201?
The molecular formula of BAS 13313201 is C17H20N4O2S.
What is the molecular weight of BAS 13313201?
The molecular weight of BAS 13313201 is 344.13 g/mol.
Where can I buy BAS 13313201?
You can request a quote for BAS 13313201 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 13313201?
Yes, KEHONG BIO provides custom synthesis services for BAS 13313201 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.