(3bS,4aR)-3,4,4-trimethyl-1-(quinolin-8-yl)-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazole
TL;DR: (3bS,4aR)-3,4,4-trimethyl-1-(quinolin-8-yl)-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazole (CAS 200882-20-8) is a chemical compound with molecular formula C19H19N3 and molecular weight 289.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,4R)-3,3,9-trimethyl-7-quinolin-8-yl-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-diene
Also Known As: (3bS,4aR)-3,4,4-trimethyl-1-(quinolin-8-yl)-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazole
| Molecular Formula | C19H19N3 |
|---|---|
| Molecular Weight | 289.16 g/mol |
| LogP | 4.02462 |
| Topological Polar Surface Area | 30.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 289.1579 |
| Heavy Atoms | 22 |
| Complexity | 914.325 |
Chemical Identifiers
| CAS Number | 200882-20-8 |
|---|---|
| SMILES | CC1=NN(C2=C1[C@H]3[C@@H](C2)C3(C)C)C4=CC=CC5=C4N=CC=C5 |
Product Overview
(3bS,4aR)-3,4,4-trimethyl-1-(quinolin-8-yl)-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazole (CAS 200882-20-8), with molecular formula C19H19N3 and molecular weight 289.16 g/mol. IUPAC: (2S,4R)-3,3,9-trimethyl-7-quinolin-8-yl-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-diene.
Chemical Property Profile of (3bS,4aR)-3,4,4-trimethyl-1-(quinolin-8-yl)-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazole
Property Insights of (3bS,4aR)-3,4,4-trimethyl-1-(quinolin-8-yl)-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazole
The XLogP value of 4.02462 indicates that (3bS,4aR)-3,4,4-trimethyl-1-(quinolin-8-yl)-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.71 Ų, (3bS,4aR)-3,4,4-trimethyl-1-(quinolin-8-yl)-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3bS,4aR)-3,4,4-trimethyl-1-(quinolin-8-yl)-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazole has 0 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 (3bS,4aR)-3,4,4-trimethyl-1-(quinolin-8-yl)-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazole?
The CAS number of (3bS,4aR)-3,4,4-trimethyl-1-(quinolin-8-yl)-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazole is 200882-20-8.
What is the molecular formula of (3bS,4aR)-3,4,4-trimethyl-1-(quinolin-8-yl)-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazole?
The molecular formula of (3bS,4aR)-3,4,4-trimethyl-1-(quinolin-8-yl)-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazole is C19H19N3.
What is the molecular weight of (3bS,4aR)-3,4,4-trimethyl-1-(quinolin-8-yl)-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazole?
The molecular weight of (3bS,4aR)-3,4,4-trimethyl-1-(quinolin-8-yl)-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazole is 289.16 g/mol.
Where can I buy (3bS,4aR)-3,4,4-trimethyl-1-(quinolin-8-yl)-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazole?
You can request a quote for (3bS,4aR)-3,4,4-trimethyl-1-(quinolin-8-yl)-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3bS,4aR)-3,4,4-trimethyl-1-(quinolin-8-yl)-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazole?
Yes, KEHONG BIO provides custom synthesis services for (3bS,4aR)-3,4,4-trimethyl-1-(quinolin-8-yl)-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.