Butyranilide, 2'-chloro-4-(diethylamino)-5'-ethyl-
TL;DR: Butyranilide, 2'-chloro-4-(diethylamino)-5'-ethyl- (CAS 3100-74-1) is a chemical compound with molecular formula C16H25ClN2O and molecular weight 296.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-chloro-5-ethylphenyl)-4-(diethylamino)butanamide
Also Known As: 2'-Chloro-4-(diethylamino)-5'-ethylbutyranilide, BUTYRANILIDE, 2'-CHLORO-4-(DIETHYLAMINO)-5'-ETHYL-, gamma-Diaethylamino-3-aethyl-6-chlor-butyranilid, gamma-Diaethylamino-3-aethyl-6-chlor-butyranilid [German], N-(2-chloro-5-ethylphenyl)-4-(diethylamino)butanamide
| Molecular Formula | C16H25ClN2O |
|---|---|
| Molecular Weight | 296.17 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 296.16553 |
| Heavy Atoms | 20 |
| Complexity | 282.0 |
Chemical Identifiers
| CAS Number | 3100-74-1 |
|---|---|
| SMILES | CCC1=CC(=C(C=C1)Cl)NC(=O)CCCN(CC)CC |
| InChIKey | PQJHSQXMFUWXIM-UHFFFAOYSA-N |
Product Overview
Butyranilide, 2'-chloro-4-(diethylamino)-5'-ethyl- (CAS 3100-74-1), with molecular formula C16H25ClN2O and molecular weight 296.17 g/mol. IUPAC: N-(2-chloro-5-ethylphenyl)-4-(diethylamino)butanamide.
Chemical Property Profile of Butyranilide, 2'-chloro-4-(diethylamino)-5'-ethyl-
Property Insights of Butyranilide, 2'-chloro-4-(diethylamino)-5'-ethyl-
The XLogP value of 3.6 indicates that Butyranilide, 2'-chloro-4-(diethylamino)-5'-ethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.3 Ų, Butyranilide, 2'-chloro-4-(diethylamino)-5'-ethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyranilide, 2'-chloro-4-(diethylamino)-5'-ethyl- has 1 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 Butyranilide, 2'-chloro-4-(diethylamino)-5'-ethyl-?
The CAS number of Butyranilide, 2'-chloro-4-(diethylamino)-5'-ethyl- is 3100-74-1.
What is the molecular formula of Butyranilide, 2'-chloro-4-(diethylamino)-5'-ethyl-?
The molecular formula of Butyranilide, 2'-chloro-4-(diethylamino)-5'-ethyl- is C16H25ClN2O.
What is the molecular weight of Butyranilide, 2'-chloro-4-(diethylamino)-5'-ethyl-?
The molecular weight of Butyranilide, 2'-chloro-4-(diethylamino)-5'-ethyl- is 296.17 g/mol.
Where can I buy Butyranilide, 2'-chloro-4-(diethylamino)-5'-ethyl-?
You can request a quote for Butyranilide, 2'-chloro-4-(diethylamino)-5'-ethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyranilide, 2'-chloro-4-(diethylamino)-5'-ethyl-?
Yes, KEHONG BIO provides custom synthesis services for Butyranilide, 2'-chloro-4-(diethylamino)-5'-ethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.