BAS 00890058
TL;DR: BAS 00890058 (CAS 303060-98-2) is a chemical compound with molecular formula C24H18Br2N2O3 and molecular weight 539.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[9-bromo-2-(4-methoxyphenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]-(4-bromophenyl)methanone
Also Known As: BAS 00890058, [9-bromo-2-(4-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl](4-bromophenyl)methanone, (9-BROMO-2-(4-METHOXYPHENYL)-1,10B-DIHYDROPYRAZOLO(1,5-C)(1,3)BENZOXAZIN-5-YL)(4-BROMOPHENYL)METHANONE, [9-bromo-2-(4-methoxyphenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]-(4-bromophenyl)methanone, 2-bromo-9-(4-methoxyphenyl)(6H,10aH-benzo[e]2-pyrazolino[1,5-c]1,3-oxazaperhyd roin-6-yl) 4-bromophenyl ketone
| Molecular Formula | C24H18Br2N2O3 |
|---|---|
| Molecular Weight | 539.97 g/mol |
| LogP | 5.9727 |
| Topological Polar Surface Area | 51.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 539.96844 |
| Heavy Atoms | 31 |
| Complexity | 1176.4337 |
Chemical Identifiers
| CAS Number | 303060-98-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NN3C(C2)C4=C(C=CC(=C4)Br)OC3C(=O)C5=CC=C(C=C5)Br |
Product Overview
BAS 00890058 (CAS 303060-98-2), with molecular formula C24H18Br2N2O3 and molecular weight 539.97 g/mol. IUPAC: [9-bromo-2-(4-methoxyphenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]-(4-bromophenyl)methanone.
Chemical Property Profile of BAS 00890058
Property Insights of BAS 00890058
The XLogP value of 5.9727 indicates that BAS 00890058 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.13 Ų, BAS 00890058 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00890058 has 0 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 00890058?
The CAS number of BAS 00890058 is 303060-98-2.
What is the molecular formula of BAS 00890058?
The molecular formula of BAS 00890058 is C24H18Br2N2O3.
What is the molecular weight of BAS 00890058?
The molecular weight of BAS 00890058 is 539.97 g/mol.
Where can I buy BAS 00890058?
You can request a quote for BAS 00890058 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00890058?
Yes, KEHONG BIO provides custom synthesis services for BAS 00890058 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.