C27H23BrCl2N2O
TL;DR: C27H23BrCl2N2O (CAS 1022569-45-4) is a chemical compound with molecular formula C27H23BrCl2N2O and molecular weight 540.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-bromo-2-(2,4-dichlorophenyl)-4'-phenylspiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,1'-cyclohexane]
Also Known As: 9'-bromo-2'-(2,4-dichlorophenyl)-4-phenyl-1',10b'-dihydrospiro[cyclohexane-1,5'-pyrazolo[1,5-c][1,3]benzoxazine], 9-bromo-2-(2,4-dichlorophenyl)-4'-phenyl-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,1'-cyclohexane], 9-bromo-2-(2,4-dichlorophenyl)-4'-phenylspiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,1'-cyclohexane], C27H23BrCl2N2O
| Molecular Formula | C27H23BrCl2N2O |
|---|---|
| Molecular Weight | 540.04 g/mol |
| LogP | 8.3535 |
| Topological Polar Surface Area | 24.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 540.0371 |
| Heavy Atoms | 33 |
| Complexity | 1238.1237 |
Chemical Identifiers
| CAS Number | 1022569-45-4 |
|---|---|
| SMILES | C1CC2(CCC1C3=CC=CC=C3)N4C(CC(=N4)C5=C(C=C(C=C5)Cl)Cl)C6=C(O2)C=CC(=C6)Br |
Product Overview
C27H23BrCl2N2O (CAS 1022569-45-4), with molecular formula C27H23BrCl2N2O and molecular weight 540.04 g/mol. IUPAC: 9-bromo-2-(2,4-dichlorophenyl)-4'-phenylspiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,1'-cyclohexane].
Chemical Property Profile of C27H23BrCl2N2O
Property Insights of C27H23BrCl2N2O
The XLogP value of 8.3535 indicates that C27H23BrCl2N2O is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.83 Ų, C27H23BrCl2N2O exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C27H23BrCl2N2O 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 C27H23BrCl2N2O?
The CAS number of C27H23BrCl2N2O is 1022569-45-4.
What is the molecular formula of C27H23BrCl2N2O?
The molecular formula of C27H23BrCl2N2O is C27H23BrCl2N2O.
What is the molecular weight of C27H23BrCl2N2O?
The molecular weight of C27H23BrCl2N2O is 540.04 g/mol.
Where can I buy C27H23BrCl2N2O?
You can request a quote for C27H23BrCl2N2O directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C27H23BrCl2N2O?
Yes, KEHONG BIO provides custom synthesis services for C27H23BrCl2N2O and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.