AN-329/40543555
TL;DR: AN-329/40543555 (CAS 308293-94-9) is a chemical compound with molecular formula C17H17ClN2O2S and molecular weight 348.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-[(Z)-(3,3-dimethyl-5-oxocyclohexylidene)amino]-1-benzothiophene-2-carboxamide
Also Known As: AN-329/40543555, 3-chloro-N'-(3,3-dimethyl-5-oxocyclohexylidene)-1-benzo[b]thiophene-2-carbohydrazide, 3-chloro-N'-(3,3-dimethyl-5-oxocyclohexylidene)-1-benzothiophene-2-carbohydrazide, 3-Chloro-N'-[(1Z)-3,3-dimethyl-5-oxocyclohexylidene]-1-benzothiophene-2-carbohydrazide, 3-Chloro-N'-[(1Z)-3,3-dimethyl-5-oxocyclohexylidene]-1-benzothiophene-2-carbohydrazide #
| Molecular Formula | C17H17ClN2O2S |
|---|---|
| Molecular Weight | 348.07 g/mol |
| LogP | 4.4197 |
| Topological Polar Surface Area | 58.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 348.06992 |
| Heavy Atoms | 23 |
| Complexity | 823.1077 |
Chemical Identifiers
| CAS Number | 308293-94-9 |
|---|---|
| SMILES | CC1(C/C(=N/NC(=O)C2=C(C3=CC=CC=C3S2)Cl)/CC(=O)C1)C |
Product Overview
AN-329/40543555 (CAS 308293-94-9), with molecular formula C17H17ClN2O2S and molecular weight 348.07 g/mol. IUPAC: 3-chloro-N-[(Z)-(3,3-dimethyl-5-oxocyclohexylidene)amino]-1-benzothiophene-2-carboxamide.
Chemical Property Profile of AN-329/40543555
Property Insights of AN-329/40543555
The XLogP value of 4.4197 indicates that AN-329/40543555 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.53 Ų, AN-329/40543555 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AN-329/40543555 has 1 hydrogen bond donor(s) and 4 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 AN-329/40543555?
The CAS number of AN-329/40543555 is 308293-94-9.
What is the molecular formula of AN-329/40543555?
The molecular formula of AN-329/40543555 is C17H17ClN2O2S.
What is the molecular weight of AN-329/40543555?
The molecular weight of AN-329/40543555 is 348.07 g/mol.
Where can I buy AN-329/40543555?
You can request a quote for AN-329/40543555 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-329/40543555?
Yes, KEHONG BIO provides custom synthesis services for AN-329/40543555 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.