AB00673957-01
TL;DR: AB00673957-01 (CAS 888410-92-2) is a chemical compound with molecular formula C21H17N3O2S3 and molecular weight 439.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(1,3-benzothiazol-2-yl)-N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide
Also Known As: AB00673957-01, F1301-0276, 5-(1,3-benzothiazol-2-yl)-N-(5,5-dimethyl-7-oxo-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide, 5-(benzo[d]thiazol-2-yl)-N-(5,5-dimethyl-7-oxo-4,5,6,7-tetrahydrobenzo[d]thiazol-2-yl)thiophene-2-carboxamide, 5-(1,3-benzothiazol-2-yl)-N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide
| Molecular Formula | C21H17N3O2S3 |
|---|---|
| Molecular Weight | 439.05 g/mol |
| LogP | 5.8887 |
| Topological Polar Surface Area | 71.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 439.04828 |
| Heavy Atoms | 29 |
| Complexity | 1232.1855 |
Chemical Identifiers
| CAS Number | 888410-92-2 |
|---|---|
| SMILES | CC1(CC2=C(C(=O)C1)SC(=N2)NC(=O)C3=CC=C(S3)C4=NC5=CC=CC=C5S4)C |
Product Overview
AB00673957-01 (CAS 888410-92-2), with molecular formula C21H17N3O2S3 and molecular weight 439.05 g/mol. IUPAC: 5-(1,3-benzothiazol-2-yl)-N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide.
Chemical Property Profile of AB00673957-01
Property Insights of AB00673957-01
The XLogP value of 5.8887 indicates that AB00673957-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.95 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00673957-01. Following Lipinski's Rule of Five, AB00673957-01 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00673957-01?
The CAS number of AB00673957-01 is 888410-92-2.
What is the molecular formula of AB00673957-01?
The molecular formula of AB00673957-01 is C21H17N3O2S3.
What is the molecular weight of AB00673957-01?
The molecular weight of AB00673957-01 is 439.05 g/mol.
Where can I buy AB00673957-01?
You can request a quote for AB00673957-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00673957-01?
Yes, KEHONG BIO provides custom synthesis services for AB00673957-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.