1-Methyl-3-(4-methylanilino)thiourea
TL;DR: 1-Methyl-3-(4-methylanilino)thiourea (CAS 27587-87-7) is a chemical compound with molecular formula C9H13N3S and molecular weight 195.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-3-(4-methylanilino)thiourea
Also Known As: 1-methyl-3-(4-methylanilino)thiourea, N-methyl-2-(p-tolyl)hydrazinecarbothioamide, 3-METHYL-1-[(4-METHYLPHENYL)AMINO]THIOUREA, N-Methyl-2-(4-methylphenyl)hydrazine-1-carbothioamide, (methylamino)[2-(4-methylphenyl)hydrazino]methane-1-thione
| Molecular Formula | C9H13N3S |
|---|---|
| Molecular Weight | 195.08 g/mol |
| LogP | 1.41582 |
| Topological Polar Surface Area | 36.09 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 195.08302 |
| Heavy Atoms | 13 |
| Complexity | 281.41623 |
Chemical Identifiers
| CAS Number | 27587-87-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NNC(=S)NC |
Product Overview
1-Methyl-3-(4-methylanilino)thiourea (CAS 27587-87-7), with molecular formula C9H13N3S and molecular weight 195.08 g/mol. IUPAC: 1-methyl-3-(4-methylanilino)thiourea.
Chemical Property Profile of 1-Methyl-3-(4-methylanilino)thiourea
Property Insights of 1-Methyl-3-(4-methylanilino)thiourea
The XLogP value of 1.41582 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-3-(4-methylanilino)thiourea. With a topological polar surface area (TPSA) of 36.09 Ų, 1-Methyl-3-(4-methylanilino)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-3-(4-methylanilino)thiourea has 3 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-Methyl-3-(4-methylanilino)thiourea?
The CAS number of 1-Methyl-3-(4-methylanilino)thiourea is 27587-87-7.
What is the molecular formula of 1-Methyl-3-(4-methylanilino)thiourea?
The molecular formula of 1-Methyl-3-(4-methylanilino)thiourea is C9H13N3S.
What is the molecular weight of 1-Methyl-3-(4-methylanilino)thiourea?
The molecular weight of 1-Methyl-3-(4-methylanilino)thiourea is 195.08 g/mol.
Where can I buy 1-Methyl-3-(4-methylanilino)thiourea?
You can request a quote for 1-Methyl-3-(4-methylanilino)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-3-(4-methylanilino)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-3-(4-methylanilino)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.