![Benzo[f]cyclopenta[a]quinolizine-6,7,7a,8,9,10(8H)-hexacarboxylic acid, 6,7,9,10,11,12-hexahydro-, hexamethyl ester structure](/static/products/496/49616-75-3.png)
Benzo[f]cyclopenta[a]quinolizine-6,7,7a,8,9,10(8H)-hexacarboxylic acid, 6,7,9,10,11,12-hexahydro-, hexamethyl ester
TL;DR: Benzo[f]cyclopenta[a]quinolizine-6,7,7a,8,9,10(8H)-hexacarboxylic acid, 6,7,9,10,11,12-hexahydro-, hexamethyl ester (CAS 49616-75-3) is a chemical compound with molecular formula C28H31NO12 and molecular weight 573.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hexamethyl 1-azatetracyclo[8.7.0.02,7.011,15]heptadeca-2,4,6,10-tetraene-12,13,14,15,16,17-hexacarboxylate
Also Known As: Benzo[f]cyclopenta[a]quinolizine-6,7,7a,8,9,10(8H)-hexacarboxylic acid, 6,7,9,10,11,12-hexahydro-, hexamethyl ester, 12,13,14,15,16,17-hexamethyl 1-azatetracyclo[8.7.0.02,7.011,15]heptadeca-2,4,6,10-tetraene-12,13,14,15,16,17-hexacarboxylate, 6,7,9,10,11,12-Hexahydrobenzo[f]cyclopenta[a]quinolizine-6,7,7a,8,9,10 -hexacarboxylicacidhexamethylester, 6,7,9,10,11,12-Hexahydrobenzo[f]cyclopenta[a]quinolizine-6,7,7a,8,9,10(8H)-hexacarboxylic acid hexamethyl ester, Hexamethyl 6,7,9,10,11,12-hexahydrocyclopenta[3,4]pyrido[1,2-a]quinoline-6,7,7a,8,9,10(8H)-hexacarboxylate #
| Molecular Formula | C28H31NO12 |
|---|---|
| Molecular Weight | 573.18 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 161.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 12 |
| Exact Mass | 573.18463 |
| Heavy Atoms | 41 |
| Complexity | 1160.0 |
Chemical Identifiers
| CAS Number | 49616-75-3 |
|---|---|
| SMILES | COC(=O)C1C(C2=C3CCC4=CC=CC=C4N3C(C(C2(C1C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC |
| InChIKey | WOGWTNKWPKPTKD-UHFFFAOYSA-N |
Product Overview
Benzo[f]cyclopenta[a]quinolizine-6,7,7a,8,9,10(8H)-hexacarboxylic acid, 6,7,9,10,11,12-hexahydro-, hexamethyl ester (CAS 49616-75-3), with molecular formula C28H31NO12 and molecular weight 573.18 g/mol. IUPAC: hexamethyl 1-azatetracyclo[8.7.0.02,7.011,15]heptadeca-2,4,6,10-tetraene-12,13,14,15,16,17-hexacarboxylate.
Chemical Property Profile of Benzo[f]cyclopenta[a]quinolizine-6,7,7a,8,9,10(8H)-hexacarboxylic acid, 6,7,9,10,11,12-hexahydro-, hexamethyl ester
Property Insights of Benzo[f]cyclopenta[a]quinolizine-6,7,7a,8,9,10(8H)-hexacarboxylic acid, 6,7,9,10,11,12-hexahydro-, hexamethyl ester
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzo[f]cyclopenta[a]quinolizine-6,7,7a,8,9,10(8H)-hexacarboxylic acid, 6,7,9,10,11,12-hexahydro-, hexamethyl ester. The TPSA of 161.0 Ų indicates high polarity, suggesting Benzo[f]cyclopenta[a]quinolizine-6,7,7a,8,9,10(8H)-hexacarboxylic acid, 6,7,9,10,11,12-hexahydro-, hexamethyl ester may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Benzo[f]cyclopenta[a]quinolizine-6,7,7a,8,9,10(8H)-hexacarboxylic acid, 6,7,9,10,11,12-hexahydro-, hexamethyl ester has 0 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzo[f]cyclopenta[a]quinolizine-6,7,7a,8,9,10(8H)-hexacarboxylic acid, 6,7,9,10,11,12-hexahydro-, hexamethyl ester?
The CAS number of Benzo[f]cyclopenta[a]quinolizine-6,7,7a,8,9,10(8H)-hexacarboxylic acid, 6,7,9,10,11,12-hexahydro-, hexamethyl ester is 49616-75-3.
What is the molecular formula of Benzo[f]cyclopenta[a]quinolizine-6,7,7a,8,9,10(8H)-hexacarboxylic acid, 6,7,9,10,11,12-hexahydro-, hexamethyl ester?
The molecular formula of Benzo[f]cyclopenta[a]quinolizine-6,7,7a,8,9,10(8H)-hexacarboxylic acid, 6,7,9,10,11,12-hexahydro-, hexamethyl ester is C28H31NO12.
What is the molecular weight of Benzo[f]cyclopenta[a]quinolizine-6,7,7a,8,9,10(8H)-hexacarboxylic acid, 6,7,9,10,11,12-hexahydro-, hexamethyl ester?
The molecular weight of Benzo[f]cyclopenta[a]quinolizine-6,7,7a,8,9,10(8H)-hexacarboxylic acid, 6,7,9,10,11,12-hexahydro-, hexamethyl ester is 573.18 g/mol.
Where can I buy Benzo[f]cyclopenta[a]quinolizine-6,7,7a,8,9,10(8H)-hexacarboxylic acid, 6,7,9,10,11,12-hexahydro-, hexamethyl ester?
You can request a quote for Benzo[f]cyclopenta[a]quinolizine-6,7,7a,8,9,10(8H)-hexacarboxylic acid, 6,7,9,10,11,12-hexahydro-, hexamethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzo[f]cyclopenta[a]quinolizine-6,7,7a,8,9,10(8H)-hexacarboxylic acid, 6,7,9,10,11,12-hexahydro-, hexamethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzo[f]cyclopenta[a]quinolizine-6,7,7a,8,9,10(8H)-hexacarboxylic acid, 6,7,9,10,11,12-hexahydro-, hexamethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.