BAS 00751180
TL;DR: BAS 00751180 (CAS 57303-29-4) is a chemical compound with molecular formula C13H10ClN3OS2 and molecular weight 323.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-6-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-1-benzothiophene-2-carboxamide
Also Known As: BAS 00751180, 3-chloro-6-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-1-benzothiophene-2-carboxamide, AB00093618-01, benzo[b]thiophene-2-carboxamide, 3-chloro-6-methyl-n-(5-methyl-1,3,4-thiadiazol-2-yl)-, (3-chloro-6-methylbenzo[b]thiophen-2-yl)-N-(5-methyl(1,3,4-thiadiazol-2-yl))ca rboxamide
| Molecular Formula | C13H10ClN3OS2 |
|---|---|
| Molecular Weight | 323.00 g/mol |
| LogP | 4.27534 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 322.9954 |
| Heavy Atoms | 20 |
| Complexity | 809.15894 |
Chemical Identifiers
| CAS Number | 57303-29-4 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)C(=C(S2)C(=O)NC3=NN=C(S3)C)Cl |
Product Overview
BAS 00751180 (CAS 57303-29-4), with molecular formula C13H10ClN3OS2 and molecular weight 323.00 g/mol. IUPAC: 3-chloro-6-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-1-benzothiophene-2-carboxamide.
Chemical Property Profile of BAS 00751180
Property Insights of BAS 00751180
The XLogP value of 4.27534 indicates that BAS 00751180 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.88 Ų, BAS 00751180 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00751180 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 00751180?
The CAS number of BAS 00751180 is 57303-29-4.
What is the molecular formula of BAS 00751180?
The molecular formula of BAS 00751180 is C13H10ClN3OS2.
What is the molecular weight of BAS 00751180?
The molecular weight of BAS 00751180 is 323.00 g/mol.
Where can I buy BAS 00751180?
You can request a quote for BAS 00751180 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00751180?
Yes, KEHONG BIO provides custom synthesis services for BAS 00751180 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.