(3-Methyl-butyl)-thiourea
TL;DR: (3-Methyl-butyl)-thiourea (CAS 6601-04-3) is a chemical compound with molecular formula C6H14N2S and molecular weight 146.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methylbutylthiourea
Also Known As: (3-Methyl-butyl)-thiourea, (3-methylbutyl)thiourea, isopentyl-thiourea, 3-methylbutylthiourea, Isoamylthioharnstoff
| Molecular Formula | C6H14N2S |
|---|---|
| Molecular Weight | 146.09 g/mol |
| LogP | 0.8657 |
| Topological Polar Surface Area | 38.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 146.08777 |
| Heavy Atoms | 9 |
| Complexity | 91.05865 |
Chemical Identifiers
| CAS Number | 6601-04-3 |
|---|---|
| SMILES | CC(C)CCNC(=S)N |
Product Overview
(3-Methyl-butyl)-thiourea (CAS 6601-04-3), with molecular formula C6H14N2S and molecular weight 146.09 g/mol. IUPAC: 3-methylbutylthiourea.
Chemical Property Profile of (3-Methyl-butyl)-thiourea
Property Insights of (3-Methyl-butyl)-thiourea
The XLogP value of 0.8657 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3-Methyl-butyl)-thiourea. With a topological polar surface area (TPSA) of 38.05 Ų, (3-Methyl-butyl)-thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3-Methyl-butyl)-thiourea has 2 hydrogen bond donor(s) and 1 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 (3-Methyl-butyl)-thiourea?
The CAS number of (3-Methyl-butyl)-thiourea is 6601-04-3.
What is the molecular formula of (3-Methyl-butyl)-thiourea?
The molecular formula of (3-Methyl-butyl)-thiourea is C6H14N2S.
What is the molecular weight of (3-Methyl-butyl)-thiourea?
The molecular weight of (3-Methyl-butyl)-thiourea is 146.09 g/mol.
Where can I buy (3-Methyl-butyl)-thiourea?
You can request a quote for (3-Methyl-butyl)-thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-Methyl-butyl)-thiourea?
Yes, KEHONG BIO provides custom synthesis services for (3-Methyl-butyl)-thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.