BAS 09092183
TL;DR: BAS 09092183 (CAS 956949-80-7) is a chemical compound with molecular formula C18H19BrN4O3 and molecular weight 418.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(5-bromo-2-prop-2-enoxyphenyl)-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)methyl]-5-methyl-1,2-dihydropyrazol-3-one
Also Known As: BAS 09092183, 4,4'-{[5-bromo-2-(prop-2-en-1-yloxy)phenyl]methanediyl}bis(3-methyl-1H-pyrazol-5-ol), 4,4'-({5-Bromo-2-[(prop-2-en-1-yl)oxy]phenyl}methylene)bis(5-methyl-1,2-dihydro-3H-pyrazol-3-one), 4,4a(2)-[[5-Bromo-2-(2-propen-1-yloxy)phenyl]methylene]bis[1,2-dihydro-5-methyl-3H-pyrazol-3-one], 4-[(5-bromo-2-prop-2-enoxyphenyl)-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)methyl]-5-methyl-1,2-dihydropyrazol-3-one
| Molecular Formula | C18H19BrN4O3 |
|---|---|
| Molecular Weight | 418.06 g/mol |
| LogP | 2.84374 |
| Topological Polar Surface Area | 106.53 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 418.06406 |
| Heavy Atoms | 26 |
| Complexity | 1002.81354 |
Chemical Identifiers
| CAS Number | 956949-80-7 |
|---|---|
| SMILES | CC1=C(C(=O)NN1)C(C2=C(C=CC(=C2)Br)OCC=C)C3=C(NNC3=O)C |
Product Overview
BAS 09092183 (CAS 956949-80-7), with molecular formula C18H19BrN4O3 and molecular weight 418.06 g/mol. IUPAC: 4-[(5-bromo-2-prop-2-enoxyphenyl)-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)methyl]-5-methyl-1,2-dihydropyrazol-3-one.
Chemical Property Profile of BAS 09092183
Property Insights of BAS 09092183
The XLogP value of 2.84374 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 09092183. The TPSA of 106.53 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 09092183. Following Lipinski's Rule of Five, BAS 09092183 has 4 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 BAS 09092183?
The CAS number of BAS 09092183 is 956949-80-7.
What is the molecular formula of BAS 09092183?
The molecular formula of BAS 09092183 is C18H19BrN4O3.
What is the molecular weight of BAS 09092183?
The molecular weight of BAS 09092183 is 418.06 g/mol.
Where can I buy BAS 09092183?
You can request a quote for BAS 09092183 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 09092183?
Yes, KEHONG BIO provides custom synthesis services for BAS 09092183 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.