2H-(1)Benzoxepino(5,4-c)pyrazole, 4,5-dihydro-9-methyl-3-(4-methylphenyl)-
TL;DR: 2H-(1)Benzoxepino(5,4-c)pyrazole, 4,5-dihydro-9-methyl-3-(4-methylphenyl)- (CAS 124392-76-3) is a chemical compound with molecular formula C19H18N2O and molecular weight 290.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-methyl-3-(4-methylphenyl)-4,5-dihydro-1H-[1]benzoxepino[4,5-d]pyrazole
Also Known As: 2H-(1)Benzoxepino(5,4-c)pyrazole, 4,5-dihydro-9-methyl-3-(4-methylphenyl)-, 4,5-Dihydro-9-methyl-3-(4-methylphenyl)-2H-(1)benzoxepino(5,4-c)pyrazole, 9-methyl-3-(4-methylphenyl)-4,5-dihydro-1H-[1]benzoxepino[5,4-c]pyrazole, BRN 4510902, RefChem:267589
| Molecular Formula | C19H18N2O |
|---|---|
| Molecular Weight | 290.14 g/mol |
| LogP | 4.29544 |
| Topological Polar Surface Area | 37.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 290.1419 |
| Heavy Atoms | 22 |
| Complexity | 831.14154 |
Chemical Identifiers
| CAS Number | 124392-76-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NNC3=C2CCOC4=C3C=C(C=C4)C |
Product Overview
2H-(1)Benzoxepino(5,4-c)pyrazole, 4,5-dihydro-9-methyl-3-(4-methylphenyl)- (CAS 124392-76-3), with molecular formula C19H18N2O and molecular weight 290.14 g/mol. IUPAC: 9-methyl-3-(4-methylphenyl)-4,5-dihydro-1H-[1]benzoxepino[4,5-d]pyrazole.
Chemical Property Profile of 2H-(1)Benzoxepino(5,4-c)pyrazole, 4,5-dihydro-9-methyl-3-(4-methylphenyl)-
Property Insights of 2H-(1)Benzoxepino(5,4-c)pyrazole, 4,5-dihydro-9-methyl-3-(4-methylphenyl)-
The XLogP value of 4.29544 indicates that 2H-(1)Benzoxepino(5,4-c)pyrazole, 4,5-dihydro-9-methyl-3-(4-methylphenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.91 Ų, 2H-(1)Benzoxepino(5,4-c)pyrazole, 4,5-dihydro-9-methyl-3-(4-methylphenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-(1)Benzoxepino(5,4-c)pyrazole, 4,5-dihydro-9-methyl-3-(4-methylphenyl)- has 1 hydrogen bond donor(s) and 2 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 2H-(1)Benzoxepino(5,4-c)pyrazole, 4,5-dihydro-9-methyl-3-(4-methylphenyl)-?
The CAS number of 2H-(1)Benzoxepino(5,4-c)pyrazole, 4,5-dihydro-9-methyl-3-(4-methylphenyl)- is 124392-76-3.
What is the molecular formula of 2H-(1)Benzoxepino(5,4-c)pyrazole, 4,5-dihydro-9-methyl-3-(4-methylphenyl)-?
The molecular formula of 2H-(1)Benzoxepino(5,4-c)pyrazole, 4,5-dihydro-9-methyl-3-(4-methylphenyl)- is C19H18N2O.
What is the molecular weight of 2H-(1)Benzoxepino(5,4-c)pyrazole, 4,5-dihydro-9-methyl-3-(4-methylphenyl)-?
The molecular weight of 2H-(1)Benzoxepino(5,4-c)pyrazole, 4,5-dihydro-9-methyl-3-(4-methylphenyl)- is 290.14 g/mol.
Where can I buy 2H-(1)Benzoxepino(5,4-c)pyrazole, 4,5-dihydro-9-methyl-3-(4-methylphenyl)-?
You can request a quote for 2H-(1)Benzoxepino(5,4-c)pyrazole, 4,5-dihydro-9-methyl-3-(4-methylphenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-(1)Benzoxepino(5,4-c)pyrazole, 4,5-dihydro-9-methyl-3-(4-methylphenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2H-(1)Benzoxepino(5,4-c)pyrazole, 4,5-dihydro-9-methyl-3-(4-methylphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.