AB00673874-01
TL;DR: AB00673874-01 (CAS 864860-39-9) is a chemical compound with molecular formula C22H25N3O3S2 and molecular weight 443.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(1,3-benzothiazole-6-carbonylamino)-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridine-3-carboxylate
Also Known As: AB00673874-01, F1299-0297, ethyl 2-(1,3-benzothiazole-6-carbonylamino)-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridine-3-carboxylate, ethyl 2-(benzo[d]thiazole-6-carboxamido)-5,5,7,7-tetramethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate
| Molecular Formula | C22H25N3O3S2 |
|---|---|
| Molecular Weight | 443.13 g/mol |
| LogP | 4.9462 |
| Topological Polar Surface Area | 80.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 443.13373 |
| Heavy Atoms | 30 |
| Complexity | 1143.91 |
Chemical Identifiers
| CAS Number | 864860-39-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CC(NC2(C)C)(C)C)NC(=O)C3=CC4=C(C=C3)N=CS4 |
Product Overview
AB00673874-01 (CAS 864860-39-9), with molecular formula C22H25N3O3S2 and molecular weight 443.13 g/mol. IUPAC: ethyl 2-(1,3-benzothiazole-6-carbonylamino)-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridine-3-carboxylate.
Chemical Property Profile of AB00673874-01
Property Insights of AB00673874-01
The XLogP value of 4.9462 indicates that AB00673874-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.32 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00673874-01. Following Lipinski's Rule of Five, AB00673874-01 has 2 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 AB00673874-01?
The CAS number of AB00673874-01 is 864860-39-9.
What is the molecular formula of AB00673874-01?
The molecular formula of AB00673874-01 is C22H25N3O3S2.
What is the molecular weight of AB00673874-01?
The molecular weight of AB00673874-01 is 443.13 g/mol.
Where can I buy AB00673874-01?
You can request a quote for AB00673874-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00673874-01?
Yes, KEHONG BIO provides custom synthesis services for AB00673874-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.