N-(1,3-benzoxazol-6-yl)thiourea
TL;DR: N-(1,3-benzoxazol-6-yl)thiourea (CAS 861208-82-4) 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-benzoxazol-6-ylthiourea
Also Known As: 1,3-benzoxazol-6-ylthiourea, N-(1,3-benzoxazol-6-yl)thiourea, (1,3-benzoxazol-6-yl)thiourea, 2P-070
| Molecular Formula | C8H7N3OS |
|---|---|
| Molecular Weight | 193.03 g/mol |
| LogP | 1.4833 |
| Topological Polar Surface Area | 64.08 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 193.03099 |
| Heavy Atoms | 13 |
| Complexity | 451.3408 |
Chemical Identifiers
| CAS Number | 861208-82-4 |
|---|---|
| SMILES | C1=CC2=C(C=C1NC(=S)N)OC=N2 |
Product Overview
N-(1,3-benzoxazol-6-yl)thiourea (CAS 861208-82-4), with molecular formula C8H7N3OS and molecular weight 193.03 g/mol. IUPAC: 1,3-benzoxazol-6-ylthiourea.
Chemical Property Profile of N-(1,3-benzoxazol-6-yl)thiourea
Property Insights of N-(1,3-benzoxazol-6-yl)thiourea
The XLogP value of 1.4833 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,3-benzoxazol-6-yl)thiourea. The TPSA of 64.08 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-benzoxazol-6-yl)thiourea. Following Lipinski's Rule of Five, N-(1,3-benzoxazol-6-yl)thiourea 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 N-(1,3-benzoxazol-6-yl)thiourea?
The CAS number of N-(1,3-benzoxazol-6-yl)thiourea is 861208-82-4.
What is the molecular formula of N-(1,3-benzoxazol-6-yl)thiourea?
The molecular formula of N-(1,3-benzoxazol-6-yl)thiourea is C8H7N3OS.
What is the molecular weight of N-(1,3-benzoxazol-6-yl)thiourea?
The molecular weight of N-(1,3-benzoxazol-6-yl)thiourea is 193.03 g/mol.
Where can I buy N-(1,3-benzoxazol-6-yl)thiourea?
You can request a quote for N-(1,3-benzoxazol-6-yl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,3-benzoxazol-6-yl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzoxazol-6-yl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.