BAS 00444511
TL;DR: BAS 00444511 (CAS 133559-97-4) is a chemical compound with molecular formula C23H13BrCl3NO3 and molecular weight 534.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-5-chloro-N-[3-chloro-4-(1-chloronaphthalen-2-yl)oxyphenyl]-2-hydroxybenzamide
Also Known As: BAS 00444511, 3-bromo-5-chloro-N-[3-chloro-4-(1-chloronaphthalen-2-yl)oxyphenyl]-2-hydroxybenzamide, 3-bromo-5-chloro-N-(3-chloro-4-((1-chloronaphthalen-2-yl)oxy)phenyl)-2-hydroxybenzamide, 3-bromo-5-chloro-N-{3-chloro-4-[(1-chloronaphthalen-2-yl)oxy]phenyl}-2-hydroxybenzamide
| Molecular Formula | C23H13BrCl3NO3 |
|---|---|
| Molecular Weight | 534.91 g/mol |
| LogP | 8.3127 |
| Topological Polar Surface Area | 58.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 534.9144 |
| Heavy Atoms | 31 |
| Complexity | 1327.2023 |
Chemical Identifiers
| CAS Number | 133559-97-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC(=C2Cl)OC3=C(C=C(C=C3)NC(=O)C4=C(C(=CC(=C4)Cl)Br)O)Cl |
Product Overview
BAS 00444511 (CAS 133559-97-4), with molecular formula C23H13BrCl3NO3 and molecular weight 534.91 g/mol. IUPAC: 3-bromo-5-chloro-N-[3-chloro-4-(1-chloronaphthalen-2-yl)oxyphenyl]-2-hydroxybenzamide.
Chemical Property Profile of BAS 00444511
Property Insights of BAS 00444511
The XLogP value of 8.3127 indicates that BAS 00444511 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.56 Ų, BAS 00444511 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00444511 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00444511?
The CAS number of BAS 00444511 is 133559-97-4.
What is the molecular formula of BAS 00444511?
The molecular formula of BAS 00444511 is C23H13BrCl3NO3.
What is the molecular weight of BAS 00444511?
The molecular weight of BAS 00444511 is 534.91 g/mol.
Where can I buy BAS 00444511?
You can request a quote for BAS 00444511 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00444511?
Yes, KEHONG BIO provides custom synthesis services for BAS 00444511 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.