Butanamide, N-1,3-benzodioxol-5-yl-4-chloro-
TL;DR: Butanamide, N-1,3-benzodioxol-5-yl-4-chloro- (CAS 298680-25-8) is a chemical compound with molecular formula C11H12ClNO3 and molecular weight 241.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-yl)-4-chlorobutanamide
Also Known As: RPL 554, Butanamide, N-1,3-benzodioxol-5-yl-4-chloro-, N-(1,3-benzodioxol-5-yl)-4-chlorobutanamide, N-benzo[1,3]dioxol-5-yl-4-chloro-butanamide, N-(benzo[d][1,3]dioxol-5-yl)-4-chlorobutanamide
| Molecular Formula | C11H12ClNO3 |
|---|---|
| Molecular Weight | 241.05 g/mol |
| LogP | 2.3728 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 241.05057 |
| Heavy Atoms | 16 |
| Complexity | 394.8161 |
Chemical Identifiers
| CAS Number | 298680-25-8 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)NC(=O)CCCCl |
Product Overview
Butanamide, N-1,3-benzodioxol-5-yl-4-chloro- (CAS 298680-25-8), with molecular formula C11H12ClNO3 and molecular weight 241.05 g/mol. IUPAC: N-(1,3-benzodioxol-5-yl)-4-chlorobutanamide.
Chemical Property Profile of Butanamide, N-1,3-benzodioxol-5-yl-4-chloro-
Property Insights of Butanamide, N-1,3-benzodioxol-5-yl-4-chloro-
The XLogP value of 2.3728 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butanamide, N-1,3-benzodioxol-5-yl-4-chloro-. With a topological polar surface area (TPSA) of 47.56 Ų, Butanamide, N-1,3-benzodioxol-5-yl-4-chloro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butanamide, N-1,3-benzodioxol-5-yl-4-chloro- 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 Butanamide, N-1,3-benzodioxol-5-yl-4-chloro-?
The CAS number of Butanamide, N-1,3-benzodioxol-5-yl-4-chloro- is 298680-25-8.
What is the molecular formula of Butanamide, N-1,3-benzodioxol-5-yl-4-chloro-?
The molecular formula of Butanamide, N-1,3-benzodioxol-5-yl-4-chloro- is C11H12ClNO3.
What is the molecular weight of Butanamide, N-1,3-benzodioxol-5-yl-4-chloro-?
The molecular weight of Butanamide, N-1,3-benzodioxol-5-yl-4-chloro- is 241.05 g/mol.
Where can I buy Butanamide, N-1,3-benzodioxol-5-yl-4-chloro-?
You can request a quote for Butanamide, N-1,3-benzodioxol-5-yl-4-chloro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butanamide, N-1,3-benzodioxol-5-yl-4-chloro-?
Yes, KEHONG BIO provides custom synthesis services for Butanamide, N-1,3-benzodioxol-5-yl-4-chloro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.