AB00669145-01
TL;DR: AB00669145-01 (CAS 862809-35-6) is a chemical compound with molecular formula C21H16ClN3O2S and molecular weight 409.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-[5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3,4-oxadiazol-2-yl]-1-benzothiophene-2-carboxamide
Also Known As: AB00669145-01, F0608-0665, 3-chloro-N-[5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3,4-oxadiazol-2-yl]-1-benzothiophene-2-carboxamide, 3-chloro-N-(5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3,4-oxadiazol-2-yl)benzo[b]thiophene-2-carboxamide, N-[5-(5,6,7,8-tetrahydro-2-naphthyl)-1,3,4-oxadiazol-2-yl]-3-chloro-1-benzothiophene-2-carboxamide
| Molecular Formula | C21H16ClN3O2S |
|---|---|
| Molecular Weight | 409.07 g/mol |
| LogP | 5.7358 |
| Topological Polar Surface Area | 68.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 409.0652 |
| Heavy Atoms | 28 |
| Complexity | 1197.5593 |
Chemical Identifiers
| CAS Number | 862809-35-6 |
|---|---|
| SMILES | C1CCC2=C(C1)C=CC(=C2)C3=NN=C(O3)NC(=O)C4=C(C5=CC=CC=C5S4)Cl |
Product Overview
AB00669145-01 (CAS 862809-35-6), with molecular formula C21H16ClN3O2S and molecular weight 409.07 g/mol. IUPAC: 3-chloro-N-[5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3,4-oxadiazol-2-yl]-1-benzothiophene-2-carboxamide.
Chemical Property Profile of AB00669145-01
Property Insights of AB00669145-01
The XLogP value of 5.7358 indicates that AB00669145-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.02 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00669145-01. Following Lipinski's Rule of Five, AB00669145-01 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00669145-01?
The CAS number of AB00669145-01 is 862809-35-6.
What is the molecular formula of AB00669145-01?
The molecular formula of AB00669145-01 is C21H16ClN3O2S.
What is the molecular weight of AB00669145-01?
The molecular weight of AB00669145-01 is 409.07 g/mol.
Where can I buy AB00669145-01?
You can request a quote for AB00669145-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00669145-01?
Yes, KEHONG BIO provides custom synthesis services for AB00669145-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.