A4144/0176559
TL;DR: A4144/0176559 (CAS 893777-63-4) is a chemical compound with molecular formula C32H30N2O7 and molecular weight 554.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[(3,4-dimethoxybenzoyl)amino]-5,6-dihydrobenzo[b][1]benzoxepin-2-yl]-3,4-dimethoxybenzamide
Also Known As: A4144/0176559, N,N'-10,11-dihydrodibenzo[b,f]oxepine-1,3-diylbis(3,4-dimethoxybenzamide), N-[4-[(3,4-dimethoxybenzoyl)amino]-5,6-dihydrobenzo[b][1]benzoxepin-2-yl]-3,4-dimethoxybenzamide
| Molecular Formula | C32H30N2O7 |
|---|---|
| Molecular Weight | 554.21 g/mol |
| LogP | 6.1165 |
| Topological Polar Surface Area | 104.35 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 554.2053 |
| Heavy Atoms | 41 |
| Complexity | 1616.1626 |
Chemical Identifiers
| CAS Number | 893777-63-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)NC2=CC(=C3CCC4=CC=CC=C4OC3=C2)NC(=O)C5=CC(=C(C=C5)OC)OC)OC |
Product Overview
A4144/0176559 (CAS 893777-63-4), with molecular formula C32H30N2O7 and molecular weight 554.21 g/mol. IUPAC: N-[4-[(3,4-dimethoxybenzoyl)amino]-5,6-dihydrobenzo[b][1]benzoxepin-2-yl]-3,4-dimethoxybenzamide.
Chemical Property Profile of A4144/0176559
Property Insights of A4144/0176559
The XLogP value of 6.1165 indicates that A4144/0176559 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.35 Ų falls within the moderate polarity range, balancing permeability and solubility for A4144/0176559. Following Lipinski's Rule of Five, A4144/0176559 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A4144/0176559?
The CAS number of A4144/0176559 is 893777-63-4.
What is the molecular formula of A4144/0176559?
The molecular formula of A4144/0176559 is C32H30N2O7.
What is the molecular weight of A4144/0176559?
The molecular weight of A4144/0176559 is 554.21 g/mol.
Where can I buy A4144/0176559?
You can request a quote for A4144/0176559 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A4144/0176559?
Yes, KEHONG BIO provides custom synthesis services for A4144/0176559 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.