(3-Imidazol-1-yl-propyl)-(4-methylsulfanyl-benzyl)-amine
TL;DR: (3-Imidazol-1-yl-propyl)-(4-methylsulfanyl-benzyl)-amine (CAS 797770-11-7) is a chemical compound with molecular formula C14H19N3S and molecular weight 261.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-imidazol-1-yl-N-[(4-methylsulfanylphenyl)methyl]propan-1-amine
Also Known As: (3-Imidazol-1-yl-propyl)-(4-methylsulfanyl-benzyl)-amine, BAS 07805574, 3-(1H-Imidazol-1-yl)-N-(4-(methylthio)benzyl)propan-1-amine, 3-imidazol-1-yl-N-[(4-methylsulfanylphenyl)methyl]propan-1-amine, (3-imidazolylpropyl)[(4-methylthiophenyl)methyl]amine
| Molecular Formula | C14H19N3S |
|---|---|
| Molecular Weight | 261.13 g/mol |
| LogP | 2.7849 |
| Topological Polar Surface Area | 29.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 261.12997 |
| Heavy Atoms | 18 |
| Complexity | 436.57248 |
Chemical Identifiers
| CAS Number | 797770-11-7 |
|---|---|
| SMILES | CSC1=CC=C(C=C1)CNCCCN2C=CN=C2 |
Product Overview
(3-Imidazol-1-yl-propyl)-(4-methylsulfanyl-benzyl)-amine (CAS 797770-11-7), with molecular formula C14H19N3S and molecular weight 261.13 g/mol. IUPAC: 3-imidazol-1-yl-N-[(4-methylsulfanylphenyl)methyl]propan-1-amine.
Chemical Property Profile of (3-Imidazol-1-yl-propyl)-(4-methylsulfanyl-benzyl)-amine
Property Insights of (3-Imidazol-1-yl-propyl)-(4-methylsulfanyl-benzyl)-amine
The XLogP value of 2.7849 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3-Imidazol-1-yl-propyl)-(4-methylsulfanyl-benzyl)-amine. With a topological polar surface area (TPSA) of 29.85 Ų, (3-Imidazol-1-yl-propyl)-(4-methylsulfanyl-benzyl)-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3-Imidazol-1-yl-propyl)-(4-methylsulfanyl-benzyl)-amine has 1 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 (3-Imidazol-1-yl-propyl)-(4-methylsulfanyl-benzyl)-amine?
The CAS number of (3-Imidazol-1-yl-propyl)-(4-methylsulfanyl-benzyl)-amine is 797770-11-7.
What is the molecular formula of (3-Imidazol-1-yl-propyl)-(4-methylsulfanyl-benzyl)-amine?
The molecular formula of (3-Imidazol-1-yl-propyl)-(4-methylsulfanyl-benzyl)-amine is C14H19N3S.
What is the molecular weight of (3-Imidazol-1-yl-propyl)-(4-methylsulfanyl-benzyl)-amine?
The molecular weight of (3-Imidazol-1-yl-propyl)-(4-methylsulfanyl-benzyl)-amine is 261.13 g/mol.
Where can I buy (3-Imidazol-1-yl-propyl)-(4-methylsulfanyl-benzyl)-amine?
You can request a quote for (3-Imidazol-1-yl-propyl)-(4-methylsulfanyl-benzyl)-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-Imidazol-1-yl-propyl)-(4-methylsulfanyl-benzyl)-amine?
Yes, KEHONG BIO provides custom synthesis services for (3-Imidazol-1-yl-propyl)-(4-methylsulfanyl-benzyl)-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.