Cambridge id 5459461
TL;DR: Cambridge id 5459461 (CAS 5459-46-1) is a chemical compound with molecular formula C14H23N3O2 and molecular weight 265.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N',N'-diethyl-N-methyl-N-[(4-nitrophenyl)methyl]ethane-1,2-diamine
Also Known As: AB00085687-01, n,n-diethyl-n'-methyl-n'-(4-nitrobenzyl)ethane-1,2-diamine, N,N-diethyl-N'-methyl-N'-(4-nitrobenzyl)-1,2-ethanediamine, N',N'-diethyl-N-methyl-N-[(4-nitrophenyl)methyl]ethane-1,2-diamine, N,N-diethyl-N'-methyl-N'-[(4-nitrophenyl)methyl]ethane-1,2-diamine
| Molecular Formula | C14H23N3O2 |
|---|---|
| Molecular Weight | 265.18 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 52.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 265.17902 |
| Heavy Atoms | 19 |
| Complexity | 256.0 |
Chemical Identifiers
| CAS Number | 5459-46-1 |
|---|---|
| SMILES | CCN(CC)CCN(C)CC1=CC=C(C=C1)[N+](=O)[O-] |
| InChIKey | KGUSEAVEYJEXDA-UHFFFAOYSA-N |
Product Overview
Cambridge id 5459461 (CAS 5459-46-1), with molecular formula C14H23N3O2 and molecular weight 265.18 g/mol. IUPAC: N',N'-diethyl-N-methyl-N-[(4-nitrophenyl)methyl]ethane-1,2-diamine.
Chemical Property Profile of Cambridge id 5459461
Property Insights of Cambridge id 5459461
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cambridge id 5459461. With a topological polar surface area (TPSA) of 52.3 Ų, Cambridge id 5459461 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cambridge id 5459461 has 0 hydrogen bond donor(s) and 4 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 Cambridge id 5459461?
The CAS number of Cambridge id 5459461 is 5459-46-1.
What is the molecular formula of Cambridge id 5459461?
The molecular formula of Cambridge id 5459461 is C14H23N3O2.
What is the molecular weight of Cambridge id 5459461?
The molecular weight of Cambridge id 5459461 is 265.18 g/mol.
Where can I buy Cambridge id 5459461?
You can request a quote for Cambridge id 5459461 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cambridge id 5459461?
Yes, KEHONG BIO provides custom synthesis services for Cambridge id 5459461 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.