1,3-Benzothiazol-2-ylurea
TL;DR: 1,3-Benzothiazol-2-ylurea (CAS 32568-55-1) is a chemical compound with molecular formula C8H7N3OS and molecular weight 193.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-benzothiazol-2-ylurea
Also Known As: 1,3-Benzothiazol-2-ylurea, benzthiazolylurea, Benzothiazol-2-ylurea, 1-(Benzothiazol-2-yl)urea, 1-(benzo[d]thiazol-2-yl)urea
| Molecular Formula | C8H7N3OS |
|---|---|
| Molecular Weight | 193.03 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 96.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 193.03099 |
| Heavy Atoms | 13 |
| Complexity | 212.0 |
Chemical Identifiers
| CAS Number | 32568-55-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)NC(=O)N |
| InChIKey | AYQVYEBEWIDXRO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Benzothiazol-2-ylurea (CAS 32568-55-1), with molecular formula C8H7N3OS and molecular weight 193.03 g/mol. IUPAC: 1,3-benzothiazol-2-ylurea.
Chemical Property Profile of 1,3-Benzothiazol-2-ylurea
Property Insights of 1,3-Benzothiazol-2-ylurea
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Benzothiazol-2-ylurea. The TPSA of 96.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Benzothiazol-2-ylurea. Following Lipinski's Rule of Five, 1,3-Benzothiazol-2-ylurea has 2 hydrogen bond donor(s) and 3 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 1,3-Benzothiazol-2-ylurea?
The CAS number of 1,3-Benzothiazol-2-ylurea is 32568-55-1.
What is the molecular formula of 1,3-Benzothiazol-2-ylurea?
The molecular formula of 1,3-Benzothiazol-2-ylurea is C8H7N3OS.
What is the molecular weight of 1,3-Benzothiazol-2-ylurea?
The molecular weight of 1,3-Benzothiazol-2-ylurea is 193.03 g/mol.
Where can I buy 1,3-Benzothiazol-2-ylurea?
You can request a quote for 1,3-Benzothiazol-2-ylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Benzothiazol-2-ylurea?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Benzothiazol-2-ylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.