![4'-(4-bromophenyl)-3,4,4',5'-tetrahydro-1H-spiro[naphthalene-2,3'-pyrazol]-1-one structure](/static/products/799/799831-91-7.png)
4'-(4-bromophenyl)-3,4,4',5'-tetrahydro-1H-spiro[naphthalene-2,3'-pyrazol]-1-one
TL;DR: 4'-(4-bromophenyl)-3,4,4',5'-tetrahydro-1H-spiro[naphthalene-2,3'-pyrazol]-1-one (CAS 799831-91-7) is a chemical compound with molecular formula C18H15BrN2O and molecular weight 354.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4'-(4-bromophenyl)spiro[3,4-dihydronaphthalene-2,5'-3,4-dihydropyrazole]-1-one
Also Known As: 4-(4-bromophenyl)spiro[1-pyrazoline-3,2''-tetralin]-1''-one, 4'-(4-bromophenyl)-3,4,4',5'-tetrahydro-1H-spiro[naphthalene-2,3'-pyrazol]-1-one, 4''-(4-bromophenyl)-1-spiro[3,4-dihydronaphthalene-2,5''-3,4-dihydropyrazole]one, 4''-(4-bromophenyl)spiro[3,4-dihydronaphthalene-2,5''-3,4-dihydropyrazole]-1-one, 4'-(4-bromophenyl)spiro[3,4-dihydronaphthalene-2,5'-3,4-dihydropyrazole]-1-one
| Molecular Formula | C18H15BrN2O |
|---|---|
| Molecular Weight | 354.04 g/mol |
| LogP | 4.5664 |
| Topological Polar Surface Area | 41.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 354.03677 |
| Heavy Atoms | 22 |
| Complexity | 768.91156 |
Chemical Identifiers
| CAS Number | 799831-91-7 |
|---|---|
| SMILES | C1CC2(C(CN=N2)C3=CC=C(C=C3)Br)C(=O)C4=CC=CC=C41 |
Product Overview
4'-(4-bromophenyl)-3,4,4',5'-tetrahydro-1H-spiro[naphthalene-2,3'-pyrazol]-1-one (CAS 799831-91-7), with molecular formula C18H15BrN2O and molecular weight 354.04 g/mol. IUPAC: 4'-(4-bromophenyl)spiro[3,4-dihydronaphthalene-2,5'-3,4-dihydropyrazole]-1-one.
Chemical Property Profile of 4'-(4-bromophenyl)-3,4,4',5'-tetrahydro-1H-spiro[naphthalene-2,3'-pyrazol]-1-one
Property Insights of 4'-(4-bromophenyl)-3,4,4',5'-tetrahydro-1H-spiro[naphthalene-2,3'-pyrazol]-1-one
The XLogP value of 4.5664 indicates that 4'-(4-bromophenyl)-3,4,4',5'-tetrahydro-1H-spiro[naphthalene-2,3'-pyrazol]-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.79 Ų, 4'-(4-bromophenyl)-3,4,4',5'-tetrahydro-1H-spiro[naphthalene-2,3'-pyrazol]-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4'-(4-bromophenyl)-3,4,4',5'-tetrahydro-1H-spiro[naphthalene-2,3'-pyrazol]-1-one has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4'-(4-bromophenyl)-3,4,4',5'-tetrahydro-1H-spiro[naphthalene-2,3'-pyrazol]-1-one?
The CAS number of 4'-(4-bromophenyl)-3,4,4',5'-tetrahydro-1H-spiro[naphthalene-2,3'-pyrazol]-1-one is 799831-91-7.
What is the molecular formula of 4'-(4-bromophenyl)-3,4,4',5'-tetrahydro-1H-spiro[naphthalene-2,3'-pyrazol]-1-one?
The molecular formula of 4'-(4-bromophenyl)-3,4,4',5'-tetrahydro-1H-spiro[naphthalene-2,3'-pyrazol]-1-one is C18H15BrN2O.
What is the molecular weight of 4'-(4-bromophenyl)-3,4,4',5'-tetrahydro-1H-spiro[naphthalene-2,3'-pyrazol]-1-one?
The molecular weight of 4'-(4-bromophenyl)-3,4,4',5'-tetrahydro-1H-spiro[naphthalene-2,3'-pyrazol]-1-one is 354.04 g/mol.
Where can I buy 4'-(4-bromophenyl)-3,4,4',5'-tetrahydro-1H-spiro[naphthalene-2,3'-pyrazol]-1-one?
You can request a quote for 4'-(4-bromophenyl)-3,4,4',5'-tetrahydro-1H-spiro[naphthalene-2,3'-pyrazol]-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4'-(4-bromophenyl)-3,4,4',5'-tetrahydro-1H-spiro[naphthalene-2,3'-pyrazol]-1-one?
Yes, KEHONG BIO provides custom synthesis services for 4'-(4-bromophenyl)-3,4,4',5'-tetrahydro-1H-spiro[naphthalene-2,3'-pyrazol]-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.