BAS 00889797
TL;DR: BAS 00889797 (CAS 313239-94-0) is a chemical compound with molecular formula C20H19ClN2O and molecular weight 338.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)spiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,1'-cyclopentane]
Also Known As: BAS 00889797, 2'-(4-chlorophenyl)-1',10b'-dihydrospiro[cyclopentane-1,5'-pyrazolo[1,5-c][1,3]benzoxazine], 2-(4-chlorophenyl)spiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,1'-cyclopentane], 2-(4-chlorophenyl)-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,1'-cyclopentane]
| Molecular Formula | C20H19ClN2O |
|---|---|
| Molecular Weight | 338.12 g/mol |
| LogP | 5.1538 |
| Topological Polar Surface Area | 24.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 338.1186 |
| Heavy Atoms | 24 |
| Complexity | 808.6435 |
Chemical Identifiers
| CAS Number | 313239-94-0 |
|---|---|
| SMILES | C1CCC2(C1)N3C(CC(=N3)C4=CC=C(C=C4)Cl)C5=CC=CC=C5O2 |
Product Overview
BAS 00889797 (CAS 313239-94-0), with molecular formula C20H19ClN2O and molecular weight 338.12 g/mol. IUPAC: 2-(4-chlorophenyl)spiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,1'-cyclopentane].
Chemical Property Profile of BAS 00889797
Property Insights of BAS 00889797
The XLogP value of 5.1538 indicates that BAS 00889797 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.83 Ų, BAS 00889797 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00889797 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00889797?
The CAS number of BAS 00889797 is 313239-94-0.
What is the molecular formula of BAS 00889797?
The molecular formula of BAS 00889797 is C20H19ClN2O.
What is the molecular weight of BAS 00889797?
The molecular weight of BAS 00889797 is 338.12 g/mol.
Where can I buy BAS 00889797?
You can request a quote for BAS 00889797 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00889797?
Yes, KEHONG BIO provides custom synthesis services for BAS 00889797 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.