1H-1,4-Diazepin-1-amine, hexahydro-4-methyl-N-(1-phenylethyl)-
TL;DR: 1H-1,4-Diazepin-1-amine, hexahydro-4-methyl-N-(1-phenylethyl)- (CAS 87498-58-6) is a chemical compound with molecular formula C14H23N3 and molecular weight 233.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-N-(1-phenylethyl)-1,4-diazepan-1-amine
Also Known As: 4-methyl-N-(1-phenylethyl)-1,4-diazepan-1-amine, 4-methyl-N- -1,4-diazepan-1-amine, Hexahydro-4-methyl-N-(1-phenylethyl)-1H-1,4-diazepin-1-amine, 1H-1,4-Diazepin-1-amine, hexahydro-4-methyl-N-(1-phenylethyl)-, RefChem:1057729
| Molecular Formula | C14H23N3 |
|---|---|
| Molecular Weight | 233.19 g/mol |
| LogP | 1.8897 |
| Topological Polar Surface Area | 18.51 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 233.1892 |
| Heavy Atoms | 17 |
| Complexity | 325.49902 |
Chemical Identifiers
| CAS Number | 87498-58-6 |
|---|---|
| SMILES | CC(C1=CC=CC=C1)NN2CCCN(CC2)C |
Product Overview
1H-1,4-Diazepin-1-amine, hexahydro-4-methyl-N-(1-phenylethyl)- (CAS 87498-58-6), with molecular formula C14H23N3 and molecular weight 233.19 g/mol. IUPAC: 4-methyl-N-(1-phenylethyl)-1,4-diazepan-1-amine.
Chemical Property Profile of 1H-1,4-Diazepin-1-amine, hexahydro-4-methyl-N-(1-phenylethyl)-
Property Insights of 1H-1,4-Diazepin-1-amine, hexahydro-4-methyl-N-(1-phenylethyl)-
The XLogP value of 1.8897 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-1,4-Diazepin-1-amine, hexahydro-4-methyl-N-(1-phenylethyl)-. With a topological polar surface area (TPSA) of 18.51 Ų, 1H-1,4-Diazepin-1-amine, hexahydro-4-methyl-N-(1-phenylethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-1,4-Diazepin-1-amine, hexahydro-4-methyl-N-(1-phenylethyl)- 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 1H-1,4-Diazepin-1-amine, hexahydro-4-methyl-N-(1-phenylethyl)-?
The CAS number of 1H-1,4-Diazepin-1-amine, hexahydro-4-methyl-N-(1-phenylethyl)- is 87498-58-6.
What is the molecular formula of 1H-1,4-Diazepin-1-amine, hexahydro-4-methyl-N-(1-phenylethyl)-?
The molecular formula of 1H-1,4-Diazepin-1-amine, hexahydro-4-methyl-N-(1-phenylethyl)- is C14H23N3.
What is the molecular weight of 1H-1,4-Diazepin-1-amine, hexahydro-4-methyl-N-(1-phenylethyl)-?
The molecular weight of 1H-1,4-Diazepin-1-amine, hexahydro-4-methyl-N-(1-phenylethyl)- is 233.19 g/mol.
Where can I buy 1H-1,4-Diazepin-1-amine, hexahydro-4-methyl-N-(1-phenylethyl)-?
You can request a quote for 1H-1,4-Diazepin-1-amine, hexahydro-4-methyl-N-(1-phenylethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-1,4-Diazepin-1-amine, hexahydro-4-methyl-N-(1-phenylethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-1,4-Diazepin-1-amine, hexahydro-4-methyl-N-(1-phenylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.