BAS 00663608
TL;DR: BAS 00663608 (CAS 331948-19-7) is a chemical compound with molecular formula C22H16Br2N4O and molecular weight 509.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-bromoanilino)-3-[(4-bromophenyl)iminomethyl]-9-methylpyrido[1,2-a]pyrimidin-4-one
Also Known As: BAS 00663608, 2-[(4-bromophenyl)amino]-3-{(E)-[(4-bromophenyl)imino]methyl}-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one, 2-(4-bromoanilino)-3-[(4-bromophenyl)iminomethyl]-9-methylpyrido[1,2-a]pyrimidin-4-one, (E)-2-((4-bromophenyl)amino)-3-(((4-bromophenyl)imino)methyl)-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
| Molecular Formula | C22H16Br2N4O |
|---|---|
| Molecular Weight | 509.97 g/mol |
| LogP | 6.02212 |
| Topological Polar Surface Area | 58.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 509.9691 |
| Heavy Atoms | 29 |
| Complexity | 1263.2283 |
Chemical Identifiers
| CAS Number | 331948-19-7 |
|---|---|
| SMILES | CC1=CC=CN2C1=NC(=C(C2=O)C=NC3=CC=C(C=C3)Br)NC4=CC=C(C=C4)Br |
Product Overview
BAS 00663608 (CAS 331948-19-7), with molecular formula C22H16Br2N4O and molecular weight 509.97 g/mol. IUPAC: 2-(4-bromoanilino)-3-[(4-bromophenyl)iminomethyl]-9-methylpyrido[1,2-a]pyrimidin-4-one.
Chemical Property Profile of BAS 00663608
Property Insights of BAS 00663608
The XLogP value of 6.02212 indicates that BAS 00663608 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.76 Ų, BAS 00663608 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00663608 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00663608?
The CAS number of BAS 00663608 is 331948-19-7.
What is the molecular formula of BAS 00663608?
The molecular formula of BAS 00663608 is C22H16Br2N4O.
What is the molecular weight of BAS 00663608?
The molecular weight of BAS 00663608 is 509.97 g/mol.
Where can I buy BAS 00663608?
You can request a quote for BAS 00663608 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00663608?
Yes, KEHONG BIO provides custom synthesis services for BAS 00663608 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.