N-苄基-3-(4-氯苯基)丙亚胺酸
TL;DR: N-苄基-3-(4-氯苯基)丙亚胺酸 (CAS 40478-37-3) is a chemical compound with molecular formula C16H16ClNO and molecular weight 273.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-苄基-3-(4-氯苯基)丙亚胺酸
N-benzyl-3-(4-chlorophenyl)propanamide
Also Known As: N-Benzyl-p-chlorohydrocinnamamide, Hydrocinnamamide, N-benzyl-p-chloro-, N-benzyl-3-(4-chlorophenyl)propanamide, N-Benzyl-beta-4-chlorphenylpropionamid, N-Benzyl-2-(p-chlorobenzyl)acetamide
| Molecular Formula | C16H16ClNO |
|---|---|
| Molecular Weight | 273.09 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 273.09204 |
| Heavy Atoms | 19 |
| Complexity | 268.0 |
Chemical Identifiers
| CAS Number | 40478-37-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC(=O)CCC2=CC=C(C=C2)Cl |
| InChIKey | XQPWJBKUZCRBKK-UHFFFAOYSA-N |
Product Overview
N-苄基-3-(4-氯苯基)丙亚胺酸 (CAS 40478-37-3), with molecular formula C16H16ClNO and molecular weight 273.09 g/mol. IUPAC: N-benzyl-3-(4-chlorophenyl)propanamide.
Chemical Property Profile of N-苄基-3-(4-氯苯基)丙亚胺酸
Property Insights of N-苄基-3-(4-氯苯基)丙亚胺酸
The XLogP value of 3.6 indicates that N-苄基-3-(4-氯苯基)丙亚胺酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, N-苄基-3-(4-氯苯基)丙亚胺酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-苄基-3-(4-氯苯基)丙亚胺酸 has 1 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 N-苄基-3-(4-氯苯基)丙亚胺酸?
The CAS number of N-苄基-3-(4-氯苯基)丙亚胺酸 is 40478-37-3.
What is the molecular formula of N-苄基-3-(4-氯苯基)丙亚胺酸?
The molecular formula of N-苄基-3-(4-氯苯基)丙亚胺酸 is C16H16ClNO.
What is the molecular weight of N-苄基-3-(4-氯苯基)丙亚胺酸?
The molecular weight of N-苄基-3-(4-氯苯基)丙亚胺酸 is 273.09 g/mol.
Where can I buy N-苄基-3-(4-氯苯基)丙亚胺酸?
You can request a quote for N-苄基-3-(4-氯苯基)丙亚胺酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-苄基-3-(4-氯苯基)丙亚胺酸?
Yes, KEHONG BIO provides custom synthesis services for N-苄基-3-(4-氯苯基)丙亚胺酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.