6,7-Dihydrovincaleukoblastine
TL;DR: 6,7-Dihydrovincaleukoblastine (CAS 13309-27-8) is a chemical compound with molecular formula C46H60N4O9 and molecular weight 812.44 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 11-acetyloxy-12-ethyl-4-(17-ethyl-17-hydroxy-13-methoxycarbonyl-1,11-diazatetracyclo[13.3.1.04,12.05,10]nonadeca-4(12),5,7,9-tetraen-13-yl)-10-hydroxy-5-methoxy-8-methyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6-triene-10-carboxylate
Also Known As: Dihydrovinblastine, Dihydrovincaleukoblastine, 6,7-Dihydrovincaleukoblastine, Vincaleukoblastine, 6,7-dihydro-, Vincaleukoblastine, dihydro-
| Molecular Formula | C46H60N4O9 |
|---|---|
| Molecular Weight | 812.44 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 154.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 10 |
| Exact Mass | 812.43604 |
| Heavy Atoms | 59 |
| Complexity | 1650.0 |
Chemical Identifiers
| CAS Number | 13309-27-8 |
|---|---|
| SMILES | CCC12CCCN3C1C4(CC3)C(C(C2OC(=O)C)(C(=O)OC)O)N(C5=CC(=C(C=C45)C6(CC7CC(CN(C7)CCC8=C6NC9=CC=CC=C89)(CC)O)C(=O)OC)OC)C |
| InChIKey | CWRJYPJHZKVJAX-UHFFFAOYSA-N |
Product Overview
6,7-Dihydrovincaleukoblastine (CAS 13309-27-8), with molecular formula C46H60N4O9 and molecular weight 812.44 g/mol. IUPAC: methyl 11-acetyloxy-12-ethyl-4-(17-ethyl-17-hydroxy-13-methoxycarbonyl-1,11-diazatetracyclo[13.3.1.04,12.05,10]nonadeca-4(12),5,7,9-tetraen-13-yl)-10-hydroxy-5-methoxy-8-methyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6-triene-10-carboxylate.
Chemical Property Profile of 6,7-Dihydrovincaleukoblastine
Property Insights of 6,7-Dihydrovincaleukoblastine
The XLogP value of 3.8 indicates that 6,7-Dihydrovincaleukoblastine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 154.0 Ų indicates high polarity, suggesting 6,7-Dihydrovincaleukoblastine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 6,7-Dihydrovincaleukoblastine has 3 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6,7-Dihydrovincaleukoblastine?
The CAS number of 6,7-Dihydrovincaleukoblastine is 13309-27-8.
What is the molecular formula of 6,7-Dihydrovincaleukoblastine?
The molecular formula of 6,7-Dihydrovincaleukoblastine is C46H60N4O9.
What is the molecular weight of 6,7-Dihydrovincaleukoblastine?
The molecular weight of 6,7-Dihydrovincaleukoblastine is 812.44 g/mol.
Where can I buy 6,7-Dihydrovincaleukoblastine?
You can request a quote for 6,7-Dihydrovincaleukoblastine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,7-Dihydrovincaleukoblastine?
Yes, KEHONG BIO provides custom synthesis services for 6,7-Dihydrovincaleukoblastine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.