N-allyl-N'-(6-ethoxy-1,3-benzothiazol-2-yl)urea
TL;DR: N-allyl-N'-(6-ethoxy-1,3-benzothiazol-2-yl)urea (CAS 353255-63-7) is a chemical compound with molecular formula C13H15N3O2S and molecular weight 277.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-prop-2-enylurea
Also Known As: N-allyl-N'-(6-ethoxy-1,3-benzothiazol-2-yl)urea, 1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-prop-2-enylurea, AI-204/31680024, AI-204/31681005, N-Allyl-N/'-(6-ethoxy-1,3-benzothiazol-2-yl)urea
| Molecular Formula | C13H15N3O2S |
|---|---|
| Molecular Weight | 277.09 g/mol |
| LogP | 3.0025 |
| Topological Polar Surface Area | 63.25 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 277.0885 |
| Heavy Atoms | 19 |
| Complexity | 594.5859 |
Chemical Identifiers
| CAS Number | 353255-63-7 |
|---|---|
| SMILES | CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)NCC=C |
Product Overview
N-allyl-N'-(6-ethoxy-1,3-benzothiazol-2-yl)urea (CAS 353255-63-7), with molecular formula C13H15N3O2S and molecular weight 277.09 g/mol. IUPAC: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-prop-2-enylurea.
Chemical Property Profile of N-allyl-N'-(6-ethoxy-1,3-benzothiazol-2-yl)urea
Property Insights of N-allyl-N'-(6-ethoxy-1,3-benzothiazol-2-yl)urea
The XLogP value of 3.0025 indicates that N-allyl-N'-(6-ethoxy-1,3-benzothiazol-2-yl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.25 Ų falls within the moderate polarity range, balancing permeability and solubility for N-allyl-N'-(6-ethoxy-1,3-benzothiazol-2-yl)urea. Following Lipinski's Rule of Five, N-allyl-N'-(6-ethoxy-1,3-benzothiazol-2-yl)urea has 2 hydrogen bond donor(s) and 4 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-allyl-N'-(6-ethoxy-1,3-benzothiazol-2-yl)urea?
The CAS number of N-allyl-N'-(6-ethoxy-1,3-benzothiazol-2-yl)urea is 353255-63-7.
What is the molecular formula of N-allyl-N'-(6-ethoxy-1,3-benzothiazol-2-yl)urea?
The molecular formula of N-allyl-N'-(6-ethoxy-1,3-benzothiazol-2-yl)urea is C13H15N3O2S.
What is the molecular weight of N-allyl-N'-(6-ethoxy-1,3-benzothiazol-2-yl)urea?
The molecular weight of N-allyl-N'-(6-ethoxy-1,3-benzothiazol-2-yl)urea is 277.09 g/mol.
Where can I buy N-allyl-N'-(6-ethoxy-1,3-benzothiazol-2-yl)urea?
You can request a quote for N-allyl-N'-(6-ethoxy-1,3-benzothiazol-2-yl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-allyl-N'-(6-ethoxy-1,3-benzothiazol-2-yl)urea?
Yes, KEHONG BIO provides custom synthesis services for N-allyl-N'-(6-ethoxy-1,3-benzothiazol-2-yl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.