BAS 00890074
TL;DR: BAS 00890074 (CAS 303061-11-2) is a chemical compound with molecular formula C23H17BrCl2N2O3 and molecular weight 517.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[9-bromo-2-(4-methoxyphenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]-4,6-dichlorophenol
Also Known As: BAS 00890074, 2-[9-BROMO-2-(4-METHOXYPHENYL)-1,10B-DIHYDROPYRAZOLO[1,5-C][1,3]BENZOXAZIN-5-YL]-4,6-DICHLOROPHENOL, 2-(9-Bromo-2-(4-methoxyphenyl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazin-5-yl)-4,6-dichlorophenol, 2-(9-Bromo-2-(4-methoxyphenyl)-1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazin-5-YL)-4,6-dichlorophenol, 2-[9-bromo-2-(4-methoxyphenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]-4,6-dichlorophenol
| Molecular Formula | C23H17BrCl2N2O3 |
|---|---|
| Molecular Weight | 517.98 g/mol |
| LogP | 6.7124 |
| Topological Polar Surface Area | 54.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 517.98 |
| Heavy Atoms | 31 |
| Complexity | 1200.1711 |
Chemical Identifiers
| CAS Number | 303061-11-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NN3C(C2)C4=C(C=CC(=C4)Br)OC3C5=C(C(=CC(=C5)Cl)Cl)O |
Product Overview
BAS 00890074 (CAS 303061-11-2), with molecular formula C23H17BrCl2N2O3 and molecular weight 517.98 g/mol. IUPAC: 2-[9-bromo-2-(4-methoxyphenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]-4,6-dichlorophenol.
Chemical Property Profile of BAS 00890074
Property Insights of BAS 00890074
The XLogP value of 6.7124 indicates that BAS 00890074 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.29 Ų, BAS 00890074 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00890074 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00890074?
The CAS number of BAS 00890074 is 303061-11-2.
What is the molecular formula of BAS 00890074?
The molecular formula of BAS 00890074 is C23H17BrCl2N2O3.
What is the molecular weight of BAS 00890074?
The molecular weight of BAS 00890074 is 517.98 g/mol.
Where can I buy BAS 00890074?
You can request a quote for BAS 00890074 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00890074?
Yes, KEHONG BIO provides custom synthesis services for BAS 00890074 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.