AB00667950-01
TL;DR: AB00667950-01 (CAS 391867-41-7) is a chemical compound with molecular formula C18H10ClN3OS3 and molecular weight 414.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-(7-methyl-[1,3]thiazolo[4,5-g][1,3]benzothiazol-2-yl)-1-benzothiophene-2-carboxamide
Also Known As: AB00667950-01, F0463-0163, 3-chloro-N-{11-methyl-3,12-dithia-5,10-diazatricyclo[7.3.0.0^{2,6}]dodeca-1(9),2(6),4,7,10-pentaen-4-yl}-1-benzothiophene-2-carboxamide, 3-chloro-N-(7-methylbenzo[1,2-d:4,3-d']bis(thiazole)-2-yl)benzo[b]thiophene-2-carboxamide, 3-chloro-N-(7-methyl-[1,3]thiazolo[4,5-g][1,3]benzothiazol-2-yl)-1-benzothiophene-2-carboxamide
| Molecular Formula | C18H10ClN3OS3 |
|---|---|
| Molecular Weight | 414.97 g/mol |
| LogP | 6.33482 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 414.96747 |
| Heavy Atoms | 26 |
| Complexity | 1317.7251 |
Chemical Identifiers
| CAS Number | 391867-41-7 |
|---|---|
| SMILES | CC1=NC2=C(S1)C3=C(C=C2)N=C(S3)NC(=O)C4=C(C5=CC=CC=C5S4)Cl |
Product Overview
AB00667950-01 (CAS 391867-41-7), with molecular formula C18H10ClN3OS3 and molecular weight 414.97 g/mol. IUPAC: 3-chloro-N-(7-methyl-[1,3]thiazolo[4,5-g][1,3]benzothiazol-2-yl)-1-benzothiophene-2-carboxamide.
Chemical Property Profile of AB00667950-01
Property Insights of AB00667950-01
The XLogP value of 6.33482 indicates that AB00667950-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.88 Ų, AB00667950-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00667950-01 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00667950-01?
The CAS number of AB00667950-01 is 391867-41-7.
What is the molecular formula of AB00667950-01?
The molecular formula of AB00667950-01 is C18H10ClN3OS3.
What is the molecular weight of AB00667950-01?
The molecular weight of AB00667950-01 is 414.97 g/mol.
Where can I buy AB00667950-01?
You can request a quote for AB00667950-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00667950-01?
Yes, KEHONG BIO provides custom synthesis services for AB00667950-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.