AB00740382-01
TL;DR: AB00740382-01 (CAS 869872-13-9) is a chemical compound with molecular formula C16H17N3O3S and molecular weight 331.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-ethylphenyl)-2,2-dioxo-3,4-dihydropyrido[2,1-c][1,2,4]thiadiazine-9-carboxamide
Also Known As: AB00740382-01, N-(3-Ethylphenyl)-3,4-dihydropyrido[2,1-c][1,2,4]thiadiazine-9-carboxamide 2,2-dioxide, (Z)-N-(3-ethylphenyl)-2,2-dioxo-3H,4H-2??-pyrido[2,1-c][1,2,4]thiadiazine-9-carboximidic acid, N-(3-ethylphenyl)-2,2-dioxo-3,4-dihydropyrido[2,1-c][1,2,4]thiadiazine-9-carboxamide
| Molecular Formula | C16H17N3O3S |
|---|---|
| Molecular Weight | 331.10 g/mol |
| LogP | 1.6851 |
| Topological Polar Surface Area | 78.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 331.09906 |
| Heavy Atoms | 23 |
| Complexity | 837.88135 |
Chemical Identifiers
| CAS Number | 869872-13-9 |
|---|---|
| SMILES | CCC1=CC(=CC=C1)NC(=O)C2=CC=CN3C2=NS(=O)(=O)CC3 |
Product Overview
AB00740382-01 (CAS 869872-13-9), with molecular formula C16H17N3O3S and molecular weight 331.10 g/mol. IUPAC: N-(3-ethylphenyl)-2,2-dioxo-3,4-dihydropyrido[2,1-c][1,2,4]thiadiazine-9-carboxamide.
Chemical Property Profile of AB00740382-01
Property Insights of AB00740382-01
The XLogP value of 1.6851 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00740382-01. The TPSA of 78.84 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00740382-01. Following Lipinski's Rule of Five, AB00740382-01 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 AB00740382-01?
The CAS number of AB00740382-01 is 869872-13-9.
What is the molecular formula of AB00740382-01?
The molecular formula of AB00740382-01 is C16H17N3O3S.
What is the molecular weight of AB00740382-01?
The molecular weight of AB00740382-01 is 331.10 g/mol.
Where can I buy AB00740382-01?
You can request a quote for AB00740382-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00740382-01?
Yes, KEHONG BIO provides custom synthesis services for AB00740382-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.