N-(carbamothioylamino)-4-methoxybenzamide
TL;DR: N-(carbamothioylamino)-4-methoxybenzamide (CAS 833-84-1) is a chemical compound with molecular formula C9H11N3O2S and molecular weight 225.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(4-methoxybenzoyl)amino]thiourea
Also Known As: [(4-methoxybenzoyl)amino]thiourea|N-(carbamothioylamino)-4-methoxybenzamide|1-(4-methoxybenzoyl)thiosemicarbazide|2-(4-Methoxybenzoyl)hydrazine-1-carbothioamide|J1.650.332K|AB00084182-01|4-Methoxy-N -(iminomercaptomethyl)benzhydrazide|2-[(4-methoxyphenyl)carbonyl]hydrazinecarbothioamide|SR-01000208014-1|N-[(aminothioxomethyl)amino](4-methoxyphenyl)carboxamide|Benzoic acid, 4-methoxy-, 2-(aminothioxomethyl)hydrazide
| Molecular Formula | C9H11N3O2S |
|---|---|
| Molecular Weight | 225.06 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 108.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 225.0572 |
| Heavy Atoms | 15 |
| Complexity | 240.0 |
Chemical Identifiers
| CAS Number | 833-84-1 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)NNC(=S)N |
| InChIKey | FMRFJSXJWQANHE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(carbamothioylamino)-4-methoxybenzamide (CAS 833-84-1), with molecular formula C9H11N3O2S and molecular weight 225.06 g/mol. IUPAC: [(4-methoxybenzoyl)amino]thiourea.
Chemical Property Profile of N-(carbamothioylamino)-4-methoxybenzamide
Property Insights of N-(carbamothioylamino)-4-methoxybenzamide
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(carbamothioylamino)-4-methoxybenzamide. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(carbamothioylamino)-4-methoxybenzamide. Following Lipinski's Rule of Five, N-(carbamothioylamino)-4-methoxybenzamide has 3 hydrogen bond donor(s) and 3 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-(carbamothioylamino)-4-methoxybenzamide?
The CAS number of N-(carbamothioylamino)-4-methoxybenzamide is 833-84-1.
What is the molecular formula of N-(carbamothioylamino)-4-methoxybenzamide?
The molecular formula of N-(carbamothioylamino)-4-methoxybenzamide is C9H11N3O2S.
What is the molecular weight of N-(carbamothioylamino)-4-methoxybenzamide?
The molecular weight of N-(carbamothioylamino)-4-methoxybenzamide is 225.06 g/mol.
Where can I buy N-(carbamothioylamino)-4-methoxybenzamide?
You can request a quote for N-(carbamothioylamino)-4-methoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(carbamothioylamino)-4-methoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(carbamothioylamino)-4-methoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.