N-Methyl-2-(4-nitrobenzoyl)hydrazinecarbothioamide
TL;DR: N-Methyl-2-(4-nitrobenzoyl)hydrazinecarbothioamide (CAS 57295-73-5) is a chemical compound with molecular formula C9H10N4O3S and molecular weight 254.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-3-[(4-nitrobenzoyl)amino]thiourea
Also Known As: 4-Methyl-1-p-nitrobenzoylthiosemicarbazid, 1-methyl-3-[(4-nitrobenzoyl)amino]thiourea, N-Methyl-2-(4-nitrobenzoyl)hydrazinecarbothioamide, N-{[(methylamino)thioxomethyl]amino}(4-nitrophenyl)carboxamide
| Molecular Formula | C9H10N4O3S |
|---|---|
| Molecular Weight | 254.05 g/mol |
| LogP | 0.3335 |
| Topological Polar Surface Area | 96.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 254.04736 |
| Heavy Atoms | 17 |
| Complexity | 446.0591 |
Chemical Identifiers
| CAS Number | 57295-73-5 |
|---|---|
| SMILES | CNC(=S)NNC(=O)C1=CC=C(C=C1)[N+](=O)[O-] |
Product Overview
N-Methyl-2-(4-nitrobenzoyl)hydrazinecarbothioamide (CAS 57295-73-5), with molecular formula C9H10N4O3S and molecular weight 254.05 g/mol. IUPAC: 1-methyl-3-[(4-nitrobenzoyl)amino]thiourea.
Chemical Property Profile of N-Methyl-2-(4-nitrobenzoyl)hydrazinecarbothioamide
Property Insights of N-Methyl-2-(4-nitrobenzoyl)hydrazinecarbothioamide
The XLogP value of 0.3335 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Methyl-2-(4-nitrobenzoyl)hydrazinecarbothioamide. The TPSA of 96.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Methyl-2-(4-nitrobenzoyl)hydrazinecarbothioamide. Following Lipinski's Rule of Five, N-Methyl-2-(4-nitrobenzoyl)hydrazinecarbothioamide has 3 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-Methyl-2-(4-nitrobenzoyl)hydrazinecarbothioamide?
The CAS number of N-Methyl-2-(4-nitrobenzoyl)hydrazinecarbothioamide is 57295-73-5.
What is the molecular formula of N-Methyl-2-(4-nitrobenzoyl)hydrazinecarbothioamide?
The molecular formula of N-Methyl-2-(4-nitrobenzoyl)hydrazinecarbothioamide is C9H10N4O3S.
What is the molecular weight of N-Methyl-2-(4-nitrobenzoyl)hydrazinecarbothioamide?
The molecular weight of N-Methyl-2-(4-nitrobenzoyl)hydrazinecarbothioamide is 254.05 g/mol.
Where can I buy N-Methyl-2-(4-nitrobenzoyl)hydrazinecarbothioamide?
You can request a quote for N-Methyl-2-(4-nitrobenzoyl)hydrazinecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Methyl-2-(4-nitrobenzoyl)hydrazinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N-Methyl-2-(4-nitrobenzoyl)hydrazinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.