AB00684345-01
TL;DR: AB00684345-01 (CAS 391879-00-8) is a chemical compound with molecular formula C16H17N3O2S and molecular weight 315.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dimethyl-N-[2-oxo-2-[(2E)-2-(thiophen-2-ylmethylidene)hydrazinyl]ethyl]benzamide
Also Known As: AB00684345-01, (E)-3,4-dimethyl-N-(2-oxo-2-(2-(thiophen-2-ylmethylene)hydrazinyl)ethyl)benzamide, F0474-0374, 3,4-dimethyl-N-({N'-[(1E)-(thiophen-2-yl)methylidene]hydrazinecarbonyl}methyl)benzamide, 3,4-dimethyl-N-[2-oxo-2-[(2E)-2-(thiophen-2-ylmethylidene)hydrazinyl]ethyl]benzamide
| Molecular Formula | C16H17N3O2S |
|---|---|
| Molecular Weight | 315.10 g/mol |
| LogP | 2.24504 |
| Topological Polar Surface Area | 70.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 315.10416 |
| Heavy Atoms | 22 |
| Complexity | 693.4214 |
Chemical Identifiers
| CAS Number | 391879-00-8 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)NCC(=O)N/N=C/C2=CC=CS2)C |
Product Overview
AB00684345-01 (CAS 391879-00-8), with molecular formula C16H17N3O2S and molecular weight 315.10 g/mol. IUPAC: 3,4-dimethyl-N-[2-oxo-2-[(2E)-2-(thiophen-2-ylmethylidene)hydrazinyl]ethyl]benzamide.
Chemical Property Profile of AB00684345-01
Property Insights of AB00684345-01
The XLogP value of 2.24504 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00684345-01. The TPSA of 70.56 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00684345-01. Following Lipinski's Rule of Five, AB00684345-01 has 2 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 AB00684345-01?
The CAS number of AB00684345-01 is 391879-00-8.
What is the molecular formula of AB00684345-01?
The molecular formula of AB00684345-01 is C16H17N3O2S.
What is the molecular weight of AB00684345-01?
The molecular weight of AB00684345-01 is 315.10 g/mol.
Where can I buy AB00684345-01?
You can request a quote for AB00684345-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00684345-01?
Yes, KEHONG BIO provides custom synthesis services for AB00684345-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.