AB00684179-01
TL;DR: AB00684179-01 (CAS 328027-82-3) is a chemical compound with molecular formula C19H14N4O6S and molecular weight 426.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2,5-dioxopyrrolidin-1-yl)-N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)benzamide
Also Known As: AB00684179-01, 4-(2,5-dioxopyrrolidin-1-yl)-N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)benzamide, F0327-0298, 4-(2,5-dioxopyrrolidin-1-yl)-N-(4-methoxy-6-nitrobenzo[d]thiazol-2-yl)benzamide, 4-(2,5-dioxopyrrolidin-1-yl)-N-(4-methoxy-6-nitro-benzothiazol-2-yl)benzamide
| Molecular Formula | C19H14N4O6S |
|---|---|
| Molecular Weight | 426.06 g/mol |
| LogP | 3.1188 |
| Topological Polar Surface Area | 131.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 426.06342 |
| Heavy Atoms | 30 |
| Complexity | 1187.7051 |
Chemical Identifiers
| CAS Number | 328027-82-3 |
|---|---|
| SMILES | COC1=C2C(=CC(=C1)[N+](=O)[O-])SC(=N2)NC(=O)C3=CC=C(C=C3)N4C(=O)CCC4=O |
Product Overview
AB00684179-01 (CAS 328027-82-3), with molecular formula C19H14N4O6S and molecular weight 426.06 g/mol. IUPAC: 4-(2,5-dioxopyrrolidin-1-yl)-N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)benzamide.
Chemical Property Profile of AB00684179-01
Property Insights of AB00684179-01
The XLogP value of 3.1188 indicates that AB00684179-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 131.74 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00684179-01. Following Lipinski's Rule of Five, AB00684179-01 has 1 hydrogen bond donor(s) and 8 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 AB00684179-01?
The CAS number of AB00684179-01 is 328027-82-3.
What is the molecular formula of AB00684179-01?
The molecular formula of AB00684179-01 is C19H14N4O6S.
What is the molecular weight of AB00684179-01?
The molecular weight of AB00684179-01 is 426.06 g/mol.
Where can I buy AB00684179-01?
You can request a quote for AB00684179-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00684179-01?
Yes, KEHONG BIO provides custom synthesis services for AB00684179-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.