BAS 00349749
TL;DR: BAS 00349749 (CAS 331249-76-4) is a chemical compound with molecular formula C24H21N3O5 and molecular weight 431.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-4-methoxy-3-nitrobenzamide
Also Known As: BAS 00349749, N-[5-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-4-methoxy-3-nitrobenzamide, N-[5-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-3-nitro-4-methoxybenzamide
| Molecular Formula | C24H21N3O5 |
|---|---|
| Molecular Weight | 431.15 g/mol |
| LogP | 5.58916 |
| Topological Polar Surface Area | 107.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 431.14813 |
| Heavy Atoms | 32 |
| Complexity | 1373.8201 |
Chemical Identifiers
| CAS Number | 331249-76-4 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C2=NC3=CC(=CC(=C3O2)C)C)NC(=O)C4=CC(=C(C=C4)OC)[N+](=O)[O-] |
Product Overview
BAS 00349749 (CAS 331249-76-4), with molecular formula C24H21N3O5 and molecular weight 431.15 g/mol. IUPAC: N-[5-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-4-methoxy-3-nitrobenzamide.
Chemical Property Profile of BAS 00349749
Property Insights of BAS 00349749
The XLogP value of 5.58916 indicates that BAS 00349749 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.5 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00349749. Following Lipinski's Rule of Five, BAS 00349749 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00349749?
The CAS number of BAS 00349749 is 331249-76-4.
What is the molecular formula of BAS 00349749?
The molecular formula of BAS 00349749 is C24H21N3O5.
What is the molecular weight of BAS 00349749?
The molecular weight of BAS 00349749 is 431.15 g/mol.
Where can I buy BAS 00349749?
You can request a quote for BAS 00349749 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00349749?
Yes, KEHONG BIO provides custom synthesis services for BAS 00349749 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.