N-(1,3-benzodioxol-5-ylmethyl)-5-chloro-2-methoxybenzamide
TL;DR: N-(1,3-benzodioxol-5-ylmethyl)-5-chloro-2-methoxybenzamide (CAS 349538-91-6) is a chemical compound with molecular formula C16H14ClNO4 and molecular weight 319.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethyl)-5-chloro-2-methoxybenzamide
Also Known As: BAS 03034195, BIM-0046271.P001, N-(1,3-benzodioxol-5-ylmethyl)-5-chloro-2-methoxybenzamide, N-Benzo[1,3]dioxol-5-ylmethyl-5-chloro-2-methoxy-benzamide, N-(2H-benzo[3,4-d]1,3-dioxolen-5-ylmethyl)(5-chloro-2-methoxyphenyl)carboxamid e
| Molecular Formula | C16H14ClNO4 |
|---|---|
| Molecular Weight | 319.06 g/mol |
| LogP | 3.0073 |
| Topological Polar Surface Area | 56.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 319.06113 |
| Heavy Atoms | 22 |
| Complexity | 717.2872 |
Chemical Identifiers
| CAS Number | 349538-91-6 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)Cl)C(=O)NCC2=CC3=C(C=C2)OCO3 |
Product Overview
N-(1,3-benzodioxol-5-ylmethyl)-5-chloro-2-methoxybenzamide (CAS 349538-91-6), with molecular formula C16H14ClNO4 and molecular weight 319.06 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-5-chloro-2-methoxybenzamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-ylmethyl)-5-chloro-2-methoxybenzamide
Property Insights of N-(1,3-benzodioxol-5-ylmethyl)-5-chloro-2-methoxybenzamide
The XLogP value of 3.0073 indicates that N-(1,3-benzodioxol-5-ylmethyl)-5-chloro-2-methoxybenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.79 Ų, N-(1,3-benzodioxol-5-ylmethyl)-5-chloro-2-methoxybenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-ylmethyl)-5-chloro-2-methoxybenzamide has 1 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 N-(1,3-benzodioxol-5-ylmethyl)-5-chloro-2-methoxybenzamide?
The CAS number of N-(1,3-benzodioxol-5-ylmethyl)-5-chloro-2-methoxybenzamide is 349538-91-6.
What is the molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-5-chloro-2-methoxybenzamide?
The molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-5-chloro-2-methoxybenzamide is C16H14ClNO4.
What is the molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-5-chloro-2-methoxybenzamide?
The molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-5-chloro-2-methoxybenzamide is 319.06 g/mol.
Where can I buy N-(1,3-benzodioxol-5-ylmethyl)-5-chloro-2-methoxybenzamide?
You can request a quote for N-(1,3-benzodioxol-5-ylmethyl)-5-chloro-2-methoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,3-benzodioxol-5-ylmethyl)-5-chloro-2-methoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-ylmethyl)-5-chloro-2-methoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.