3-Amino-1-(6-methylheptan-2-yl)thiourea
TL;DR: 3-Amino-1-(6-methylheptan-2-yl)thiourea (CAS 747411-06-9) is a chemical compound with molecular formula C9H21N3S and molecular weight 203.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-amino-3-(6-methylheptan-2-yl)thiourea
Also Known As: 3-amino-1-(6-methylheptan-2-yl)thiourea, N-(1,5-dimethylhexyl)hydrazinecarbothioamide, 1-amino-3-(6-methylheptan-2-yl)thiourea, 1-amino-3-(1,5-dimethylhexyl)thiourea, n-(6-Methylheptan-2-yl)hydrazinecarbothioamide
| Molecular Formula | C9H21N3S |
|---|---|
| Molecular Weight | 203.15 g/mol |
| LogP | 1.539 |
| Topological Polar Surface Area | 50.08 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 203.14561 |
| Heavy Atoms | 13 |
| Complexity | 147.79524 |
Chemical Identifiers
| CAS Number | 747411-06-9 |
|---|---|
| SMILES | CC(C)CCCC(C)NC(=S)NN |
Product Overview
3-Amino-1-(6-methylheptan-2-yl)thiourea (CAS 747411-06-9), with molecular formula C9H21N3S and molecular weight 203.15 g/mol. IUPAC: 1-amino-3-(6-methylheptan-2-yl)thiourea.
Chemical Property Profile of 3-Amino-1-(6-methylheptan-2-yl)thiourea
Property Insights of 3-Amino-1-(6-methylheptan-2-yl)thiourea
The XLogP value of 1.539 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Amino-1-(6-methylheptan-2-yl)thiourea. With a topological polar surface area (TPSA) of 50.08 Ų, 3-Amino-1-(6-methylheptan-2-yl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Amino-1-(6-methylheptan-2-yl)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 3-Amino-1-(6-methylheptan-2-yl)thiourea?
The CAS number of 3-Amino-1-(6-methylheptan-2-yl)thiourea is 747411-06-9.
What is the molecular formula of 3-Amino-1-(6-methylheptan-2-yl)thiourea?
The molecular formula of 3-Amino-1-(6-methylheptan-2-yl)thiourea is C9H21N3S.
What is the molecular weight of 3-Amino-1-(6-methylheptan-2-yl)thiourea?
The molecular weight of 3-Amino-1-(6-methylheptan-2-yl)thiourea is 203.15 g/mol.
Where can I buy 3-Amino-1-(6-methylheptan-2-yl)thiourea?
You can request a quote for 3-Amino-1-(6-methylheptan-2-yl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Amino-1-(6-methylheptan-2-yl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 3-Amino-1-(6-methylheptan-2-yl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.