16,16-dimethyprostaglandin E2 4-benzaldehyde semicarbazone ester
TL;DR: 16,16-dimethyprostaglandin E2 4-benzaldehyde semicarbazone ester (CAS 62845-71-0) is a chemical compound with molecular formula C30H43N3O6 and molecular weight 541.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(E)-(carbamoylhydrazinylidene)methyl]phenyl] (Z)-7-[(1R,2R,3R)-3-hydroxy-2-[(E,3R)-3-hydroxy-4,4-dimethyloct-1-enyl]-5-oxocyclopentyl]hept-5-enoate
Also Known As: Dimethyl-PGE2-pbase, 16,16-Dimethyprostaglandin E2 4-benzaldehyde semicarbazone ester, (5Z,11alpha,13E,15R)-4-(((Aminocarbonyl)hydrazono)methyl)phenyl 11,15-dihydroxy-16,16-dimethyl-9-oxoprosta-5,13-dien-oate, [4-[(E)-(carbamoylhydrazinylidene)methyl]phenyl] (Z)-7-[(1R,2R,3R)-3-hydroxy-2-[(E,3R)-3-hydroxy-4,4-dimethyloct-1-enyl]-5-oxocyclopentyl]hept-5-enoate, Prosta-5,13-dien-oic acid, 11,15-dihydroxy-16,16-dimethyl-9-oxo-, 4-(((aminocarbonyl)hydrazono)methyl)phenyl ester, (5Z,11alpha,13E,15R)-
| Molecular Formula | C30H43N3O6 |
|---|---|
| Molecular Weight | 541.32 g/mol |
| LogP | 4.4104 |
| Topological Polar Surface Area | 151.31 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 15 |
| Exact Mass | 541.3152 |
| Heavy Atoms | 39 |
| Complexity | 1031.6382 |
Chemical Identifiers
| CAS Number | 62845-71-0 |
|---|---|
| SMILES | CCCCC(C)(C)[C@@H](/C=C/[C@H]1[C@@H](CC(=O)[C@@H]1C/C=C\CCCC(=O)OC2=CC=C(C=C2)/C=N/NC(=O)N)O)O |
Product Overview
16,16-dimethyprostaglandin E2 4-benzaldehyde semicarbazone ester (CAS 62845-71-0), with molecular formula C30H43N3O6 and molecular weight 541.32 g/mol. IUPAC: [4-[(E)-(carbamoylhydrazinylidene)methyl]phenyl] (Z)-7-[(1R,2R,3R)-3-hydroxy-2-[(E,3R)-3-hydroxy-4,4-dimethyloct-1-enyl]-5-oxocyclopentyl]hept-5-enoate.
Chemical Property Profile of 16,16-dimethyprostaglandin E2 4-benzaldehyde semicarbazone ester
Property Insights of 16,16-dimethyprostaglandin E2 4-benzaldehyde semicarbazone ester
The XLogP value of 4.4104 indicates that 16,16-dimethyprostaglandin E2 4-benzaldehyde semicarbazone ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 151.31 Ų indicates high polarity, suggesting 16,16-dimethyprostaglandin E2 4-benzaldehyde semicarbazone ester may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 16,16-dimethyprostaglandin E2 4-benzaldehyde semicarbazone ester has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 16,16-dimethyprostaglandin E2 4-benzaldehyde semicarbazone ester?
The CAS number of 16,16-dimethyprostaglandin E2 4-benzaldehyde semicarbazone ester is 62845-71-0.
What is the molecular formula of 16,16-dimethyprostaglandin E2 4-benzaldehyde semicarbazone ester?
The molecular formula of 16,16-dimethyprostaglandin E2 4-benzaldehyde semicarbazone ester is C30H43N3O6.
What is the molecular weight of 16,16-dimethyprostaglandin E2 4-benzaldehyde semicarbazone ester?
The molecular weight of 16,16-dimethyprostaglandin E2 4-benzaldehyde semicarbazone ester is 541.32 g/mol.
Where can I buy 16,16-dimethyprostaglandin E2 4-benzaldehyde semicarbazone ester?
You can request a quote for 16,16-dimethyprostaglandin E2 4-benzaldehyde semicarbazone ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 16,16-dimethyprostaglandin E2 4-benzaldehyde semicarbazone ester?
Yes, KEHONG BIO provides custom synthesis services for 16,16-dimethyprostaglandin E2 4-benzaldehyde semicarbazone ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.