BAS 00347949
TL;DR: BAS 00347949 (CAS 331247-85-9) is a chemical compound with molecular formula C16H12BrN3O3 and molecular weight 373.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-2-hydroxy-N-[(2-hydroxy-5-methyl-1H-indol-3-yl)imino]benzamide
Also Known As: BAS 00347949, 5-bromo-2-hydroxy-N'-[(3E)-5-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene]benzohydrazide, 5-bromo-2-hydroxy-N'-(5-methyl-2-oxoindol-3-yl)benzohydrazide, (E)-5-bromo-2-hydroxy-N'-(5-methyl-2-oxoindolin-3-ylidene)benzohydrazide, (5-bromo-2-hydroxyphenyl)-N-[(5-methyl-2-oxo(1H-benzo[d]azolin-3-ylidene))azam ethyl]carboxamide
| Molecular Formula | C16H12BrN3O3 |
|---|---|
| Molecular Weight | 373.01 g/mol |
| LogP | 4.57412 |
| Topological Polar Surface Area | 98.04 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 373.0062 |
| Heavy Atoms | 23 |
| Complexity | 947.1386 |
Chemical Identifiers
| CAS Number | 331247-85-9 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)NC(=C2N=NC(=O)C3=C(C=CC(=C3)Br)O)O |
Product Overview
BAS 00347949 (CAS 331247-85-9), with molecular formula C16H12BrN3O3 and molecular weight 373.01 g/mol. IUPAC: 5-bromo-2-hydroxy-N-[(2-hydroxy-5-methyl-1H-indol-3-yl)imino]benzamide.
Chemical Property Profile of BAS 00347949
Property Insights of BAS 00347949
The XLogP value of 4.57412 indicates that BAS 00347949 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.04 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00347949. Following Lipinski's Rule of Five, BAS 00347949 has 3 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 BAS 00347949?
The CAS number of BAS 00347949 is 331247-85-9.
What is the molecular formula of BAS 00347949?
The molecular formula of BAS 00347949 is C16H12BrN3O3.
What is the molecular weight of BAS 00347949?
The molecular weight of BAS 00347949 is 373.01 g/mol.
Where can I buy BAS 00347949?
You can request a quote for BAS 00347949 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00347949?
Yes, KEHONG BIO provides custom synthesis services for BAS 00347949 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.