1-(4-Methyl-2-oxochromen-7-yl)-3-(4-phenoxyphenyl)thiourea
TL;DR: 1-(4-Methyl-2-oxochromen-7-yl)-3-(4-phenoxyphenyl)thiourea (CAS 708218-72-8) is a chemical compound with molecular formula C23H18N2O3S and molecular weight 402.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methyl-2-oxochromen-7-yl)-3-(4-phenoxyphenyl)thiourea
Also Known As: 1-(4-methyl-2-oxochromen-7-yl)-3-(4-phenoxyphenyl)thiourea, 1-(4-methyl-2-oxo-2H-chromen-7-yl)-3-(4-phenoxyphenyl)thiourea, 4-methyl-7-({[(4-phenoxyphenyl)amino]thioxomethyl}amino)chromen-2-one
| Molecular Formula | C23H18N2O3S |
|---|---|
| Molecular Weight | 402.10 g/mol |
| LogP | 5.70262 |
| Topological Polar Surface Area | 63.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 402.10382 |
| Heavy Atoms | 29 |
| Complexity | 1218.5623 |
Chemical Identifiers
| CAS Number | 708218-72-8 |
|---|---|
| SMILES | CC1=CC(=O)OC2=C1C=CC(=C2)NC(=S)NC3=CC=C(C=C3)OC4=CC=CC=C4 |
Product Overview
1-(4-Methyl-2-oxochromen-7-yl)-3-(4-phenoxyphenyl)thiourea (CAS 708218-72-8), with molecular formula C23H18N2O3S and molecular weight 402.10 g/mol. IUPAC: 1-(4-methyl-2-oxochromen-7-yl)-3-(4-phenoxyphenyl)thiourea.
Chemical Property Profile of 1-(4-Methyl-2-oxochromen-7-yl)-3-(4-phenoxyphenyl)thiourea
Property Insights of 1-(4-Methyl-2-oxochromen-7-yl)-3-(4-phenoxyphenyl)thiourea
The XLogP value of 5.70262 indicates that 1-(4-Methyl-2-oxochromen-7-yl)-3-(4-phenoxyphenyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Methyl-2-oxochromen-7-yl)-3-(4-phenoxyphenyl)thiourea. Following Lipinski's Rule of Five, 1-(4-Methyl-2-oxochromen-7-yl)-3-(4-phenoxyphenyl)thiourea has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(4-Methyl-2-oxochromen-7-yl)-3-(4-phenoxyphenyl)thiourea?
The CAS number of 1-(4-Methyl-2-oxochromen-7-yl)-3-(4-phenoxyphenyl)thiourea is 708218-72-8.
What is the molecular formula of 1-(4-Methyl-2-oxochromen-7-yl)-3-(4-phenoxyphenyl)thiourea?
The molecular formula of 1-(4-Methyl-2-oxochromen-7-yl)-3-(4-phenoxyphenyl)thiourea is C23H18N2O3S.
What is the molecular weight of 1-(4-Methyl-2-oxochromen-7-yl)-3-(4-phenoxyphenyl)thiourea?
The molecular weight of 1-(4-Methyl-2-oxochromen-7-yl)-3-(4-phenoxyphenyl)thiourea is 402.10 g/mol.
Where can I buy 1-(4-Methyl-2-oxochromen-7-yl)-3-(4-phenoxyphenyl)thiourea?
You can request a quote for 1-(4-Methyl-2-oxochromen-7-yl)-3-(4-phenoxyphenyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Methyl-2-oxochromen-7-yl)-3-(4-phenoxyphenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Methyl-2-oxochromen-7-yl)-3-(4-phenoxyphenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.