AB00666970-01
TL;DR: AB00666970-01 (CAS 58248-52-5) is a chemical compound with molecular formula C17H19N3O3S and molecular weight 345.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-3-(3-methoxyphenyl)urea
Also Known As: AB00666970-01, F0174-0274, 1-(5,5-dimethyl-7-oxo-4,5,6,7-tetrahydrobenzo[d]thiazol-2-yl)-3-(3-methoxyphenyl)urea, 3-(5,5-dimethyl-7-oxo-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1-(3-methoxyphenyl)urea, 1-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-3-(3-methoxyphenyl)urea
| Molecular Formula | C17H19N3O3S |
|---|---|
| Molecular Weight | 345.11 g/mol |
| LogP | 3.9508 |
| Topological Polar Surface Area | 80.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 345.11472 |
| Heavy Atoms | 24 |
| Complexity | 798.1285 |
Chemical Identifiers
| CAS Number | 58248-52-5 |
|---|---|
| SMILES | CC1(CC2=C(C(=O)C1)SC(=N2)NC(=O)NC3=CC(=CC=C3)OC)C |
Product Overview
AB00666970-01 (CAS 58248-52-5), with molecular formula C17H19N3O3S and molecular weight 345.11 g/mol. IUPAC: 1-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-3-(3-methoxyphenyl)urea.
Chemical Property Profile of AB00666970-01
Property Insights of AB00666970-01
The XLogP value of 3.9508 indicates that AB00666970-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.32 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00666970-01. Following Lipinski's Rule of Five, AB00666970-01 has 2 hydrogen bond donor(s) and 5 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 AB00666970-01?
The CAS number of AB00666970-01 is 58248-52-5.
What is the molecular formula of AB00666970-01?
The molecular formula of AB00666970-01 is C17H19N3O3S.
What is the molecular weight of AB00666970-01?
The molecular weight of AB00666970-01 is 345.11 g/mol.
Where can I buy AB00666970-01?
You can request a quote for AB00666970-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00666970-01?
Yes, KEHONG BIO provides custom synthesis services for AB00666970-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.