BAS 01076229
TL;DR: BAS 01076229 (CAS 334505-56-5) is a chemical compound with molecular formula C25H18BrN3O2 and molecular weight 471.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(Z)-(5-bromo-1-methyl-2-oxoindol-3-ylidene)methyl]-3-(2-methylphenyl)quinazolin-4-one
Also Known As: BAS 01076229, 2-[(Z)-(5-bromo-1-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-3-(2-methylphenyl)quinazolin-4(3H)-one, (Z)-2-((5-bromo-1-methyl-2-oxoindolin-3-ylidene)methyl)-3-(o-tolyl)quinazolin-4(3H)-one, 2-[(Z)-(5-bromo-1-methyl-2-oxoindol-3-ylidene)methyl]-3-(2-methylphenyl)quinazolin-4-one, 2-[(5-bromo-1-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-3-(2-methylphenyl)-4(3H)-quinazolinone
| Molecular Formula | C25H18BrN3O2 |
|---|---|
| Molecular Weight | 471.06 g/mol |
| LogP | 4.97362 |
| Topological Polar Surface Area | 55.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 471.05823 |
| Heavy Atoms | 31 |
| Complexity | 1469.6091 |
Chemical Identifiers
| CAS Number | 334505-56-5 |
|---|---|
| SMILES | CC1=CC=CC=C1N2C(=NC3=CC=CC=C3C2=O)/C=C\4/C5=C(C=CC(=C5)Br)N(C4=O)C |
Product Overview
BAS 01076229 (CAS 334505-56-5), with molecular formula C25H18BrN3O2 and molecular weight 471.06 g/mol. IUPAC: 2-[(Z)-(5-bromo-1-methyl-2-oxoindol-3-ylidene)methyl]-3-(2-methylphenyl)quinazolin-4-one.
Chemical Property Profile of BAS 01076229
Property Insights of BAS 01076229
The XLogP value of 4.97362 indicates that BAS 01076229 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.2 Ų, BAS 01076229 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01076229 has 0 hydrogen bond donor(s) and 3 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 01076229?
The CAS number of BAS 01076229 is 334505-56-5.
What is the molecular formula of BAS 01076229?
The molecular formula of BAS 01076229 is C25H18BrN3O2.
What is the molecular weight of BAS 01076229?
The molecular weight of BAS 01076229 is 471.06 g/mol.
Where can I buy BAS 01076229?
You can request a quote for BAS 01076229 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01076229?
Yes, KEHONG BIO provides custom synthesis services for BAS 01076229 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.