4-Phenyl-1-(3,4,5-trimethoxybenzoyl)thiosemicarbazide
TL;DR: 4-Phenyl-1-(3,4,5-trimethoxybenzoyl)thiosemicarbazide (CAS 70452-38-9) is a chemical compound with molecular formula C17H19N3O4S and molecular weight 361.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-3-[(3,4,5-trimethoxybenzoyl)amino]thiourea
Also Known As: 4-PHENYL-1-(3,4,5-TRIMETHOXYBENZOYL)THIOSEMICARBAZIDE, 1-phenyl-3-[(3,4,5-trimethoxybenzoyl)amino]thiourea, 3,4,5-trimethoxy-N-[(phenylcarbamothioyl)amino]benzamide, 3-phenyl-1-[(3,4,5-trimethoxybenzoyl)amino]thiourea, 1-(3,4,5-Trimethoxybenzoyl)-4-phenylthiosemicarbazide
| Molecular Formula | C17H19N3O4S |
|---|---|
| Molecular Weight | 361.11 g/mol |
| LogP | 2.3438 |
| Topological Polar Surface Area | 80.85 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 361.10962 |
| Heavy Atoms | 25 |
| Complexity | 727.8082 |
Chemical Identifiers
| CAS Number | 70452-38-9 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=O)NNC(=S)NC2=CC=CC=C2 |
Product Overview
4-Phenyl-1-(3,4,5-trimethoxybenzoyl)thiosemicarbazide (CAS 70452-38-9), with molecular formula C17H19N3O4S and molecular weight 361.11 g/mol. IUPAC: 1-phenyl-3-[(3,4,5-trimethoxybenzoyl)amino]thiourea.
Chemical Property Profile of 4-Phenyl-1-(3,4,5-trimethoxybenzoyl)thiosemicarbazide
Property Insights of 4-Phenyl-1-(3,4,5-trimethoxybenzoyl)thiosemicarbazide
The XLogP value of 2.3438 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Phenyl-1-(3,4,5-trimethoxybenzoyl)thiosemicarbazide. The TPSA of 80.85 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Phenyl-1-(3,4,5-trimethoxybenzoyl)thiosemicarbazide. Following Lipinski's Rule of Five, 4-Phenyl-1-(3,4,5-trimethoxybenzoyl)thiosemicarbazide has 3 hydrogen bond donor(s) and 5 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 4-Phenyl-1-(3,4,5-trimethoxybenzoyl)thiosemicarbazide?
The CAS number of 4-Phenyl-1-(3,4,5-trimethoxybenzoyl)thiosemicarbazide is 70452-38-9.
What is the molecular formula of 4-Phenyl-1-(3,4,5-trimethoxybenzoyl)thiosemicarbazide?
The molecular formula of 4-Phenyl-1-(3,4,5-trimethoxybenzoyl)thiosemicarbazide is C17H19N3O4S.
What is the molecular weight of 4-Phenyl-1-(3,4,5-trimethoxybenzoyl)thiosemicarbazide?
The molecular weight of 4-Phenyl-1-(3,4,5-trimethoxybenzoyl)thiosemicarbazide is 361.11 g/mol.
Where can I buy 4-Phenyl-1-(3,4,5-trimethoxybenzoyl)thiosemicarbazide?
You can request a quote for 4-Phenyl-1-(3,4,5-trimethoxybenzoyl)thiosemicarbazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Phenyl-1-(3,4,5-trimethoxybenzoyl)thiosemicarbazide?
Yes, KEHONG BIO provides custom synthesis services for 4-Phenyl-1-(3,4,5-trimethoxybenzoyl)thiosemicarbazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.