1-(4-Diazo-3-oxobutyl)-3-phenylthiourea
TL;DR: 1-(4-Diazo-3-oxobutyl)-3-phenylthiourea (CAS 115263-37-1) is a chemical compound with molecular formula C11H12N4OS and molecular weight 248.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-diazo-3-oxobutyl)-3-phenylthiourea
Also Known As: 1-(4-diazo-3-oxobutyl)-3-phenylthiourea, 1-diazonio-4-(phenylcarbamothioylamino)but-1-en-2-olate, (Z)-1-diazonio-4-(phenylcarbamothioylamino)but-1-en-2-olate
| Molecular Formula | C11H12N4OS |
|---|---|
| Molecular Weight | 248.07 g/mol |
| LogP | 1.2328 |
| Topological Polar Surface Area | 77.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 248.07318 |
| Heavy Atoms | 17 |
| Complexity | 440.04446 |
Chemical Identifiers
| CAS Number | 115263-37-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=S)NCCC(=O)C=[N+]=[N-] |
Product Overview
1-(4-Diazo-3-oxobutyl)-3-phenylthiourea (CAS 115263-37-1), with molecular formula C11H12N4OS and molecular weight 248.07 g/mol. IUPAC: 1-(4-diazo-3-oxobutyl)-3-phenylthiourea.
Chemical Property Profile of 1-(4-Diazo-3-oxobutyl)-3-phenylthiourea
Property Insights of 1-(4-Diazo-3-oxobutyl)-3-phenylthiourea
The XLogP value of 1.2328 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Diazo-3-oxobutyl)-3-phenylthiourea. The TPSA of 77.53 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Diazo-3-oxobutyl)-3-phenylthiourea. Following Lipinski's Rule of Five, 1-(4-Diazo-3-oxobutyl)-3-phenylthiourea has 2 hydrogen bond donor(s) and 2 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-(4-Diazo-3-oxobutyl)-3-phenylthiourea?
The CAS number of 1-(4-Diazo-3-oxobutyl)-3-phenylthiourea is 115263-37-1.
What is the molecular formula of 1-(4-Diazo-3-oxobutyl)-3-phenylthiourea?
The molecular formula of 1-(4-Diazo-3-oxobutyl)-3-phenylthiourea is C11H12N4OS.
What is the molecular weight of 1-(4-Diazo-3-oxobutyl)-3-phenylthiourea?
The molecular weight of 1-(4-Diazo-3-oxobutyl)-3-phenylthiourea is 248.07 g/mol.
Where can I buy 1-(4-Diazo-3-oxobutyl)-3-phenylthiourea?
You can request a quote for 1-(4-Diazo-3-oxobutyl)-3-phenylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Diazo-3-oxobutyl)-3-phenylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Diazo-3-oxobutyl)-3-phenylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.