AB00673482-01
TL;DR: AB00673482-01 (CAS 684232-04-0) is a chemical compound with molecular formula C18H18N2O4S and molecular weight 358.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)carbamoyl]benzoate
Also Known As: AB00673482-01, F1166-0053, methyl 4-((5,5-dimethyl-7-oxo-4,5,6,7-tetrahydrobenzo[d]thiazol-2-yl)carbamoyl)benzoate, methyl 4-[(5,5-dimethyl-7-oxo-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)carbamoyl]benzoate, methyl 4-[(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)carbamoyl]benzoate
| Molecular Formula | C18H18N2O4S |
|---|---|
| Molecular Weight | 358.10 g/mol |
| LogP | 3.3371 |
| Topological Polar Surface Area | 85.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 358.09872 |
| Heavy Atoms | 25 |
| Complexity | 852.46106 |
Chemical Identifiers
| CAS Number | 684232-04-0 |
|---|---|
| SMILES | CC1(CC2=C(C(=O)C1)SC(=N2)NC(=O)C3=CC=C(C=C3)C(=O)OC)C |
Product Overview
AB00673482-01 (CAS 684232-04-0), with molecular formula C18H18N2O4S and molecular weight 358.10 g/mol. IUPAC: methyl 4-[(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)carbamoyl]benzoate.
Chemical Property Profile of AB00673482-01
Property Insights of AB00673482-01
The XLogP value of 3.3371 indicates that AB00673482-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.36 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00673482-01. Following Lipinski's Rule of Five, AB00673482-01 has 1 hydrogen bond donor(s) and 6 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 AB00673482-01?
The CAS number of AB00673482-01 is 684232-04-0.
What is the molecular formula of AB00673482-01?
The molecular formula of AB00673482-01 is C18H18N2O4S.
What is the molecular weight of AB00673482-01?
The molecular weight of AB00673482-01 is 358.10 g/mol.
Where can I buy AB00673482-01?
You can request a quote for AB00673482-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00673482-01?
Yes, KEHONG BIO provides custom synthesis services for AB00673482-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.