4-(9-羟基-4,6,8,10-四甲基-7-氧代十二碳-4-烯-2-基)-3-甲基氧杂环丁烷-2-酮
TL;DR: 4-(9-羟基-4,6,8,10-四甲基-7-氧代十二碳-4-烯-2-基)-3-甲基氧杂环丁烷-2-酮 (CAS 76808-16-7) is a chemical compound with molecular formula C20H34O4 and molecular weight 338.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(9-羟基-4,6,8,10-四甲基-7-氧代十二碳-4-烯-2-基)-3-甲基氧杂环丁烷-2-酮
4-(9-hydroxy-4,6,8,10-tetramethyl-7-oxododec-4-en-2-yl)-3-methyloxetan-2-one
Also Known As: ebelactone a, Veliparib, 3,11-Dihydroxy-2,4,6,8,10,12-hexamethyl-9-oxo-6-tetradecenoic acid 1,3-lactone, 4-(9-hydroxy-4,6,8,10-tetramethyl-7-oxododec-4-en-2-yl)-3-methyloxetan-2-one, (R)-2-(2-methylpyrrolidin-2-yl)-1H-benzo[d]imidazole-4-carboxamide
| Molecular Formula | C20H34O4 |
|---|---|
| Molecular Weight | 338.25 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 338.2457 |
| Heavy Atoms | 24 |
| Complexity | 482.0 |
Chemical Identifiers
| CAS Number | 76808-16-7 |
|---|---|
| SMILES | CCC(C)C(C(C)C(=O)C(C)C=C(C)CC(C)C1C(C(=O)O1)C)O |
| InChIKey | WOISDAHQBUYEAF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(9-羟基-4,6,8,10-四甲基-7-氧代十二碳-4-烯-2-基)-3-甲基氧杂环丁烷-2-酮 (CAS 76808-16-7), with molecular formula C20H34O4 and molecular weight 338.25 g/mol. IUPAC: 4-(9-hydroxy-4,6,8,10-tetramethyl-7-oxododec-4-en-2-yl)-3-methyloxetan-2-one.
Chemical Property Profile of 4-(9-羟基-4,6,8,10-四甲基-7-氧代十二碳-4-烯-2-基)-3-甲基氧杂环丁烷-2-酮
Property Insights of 4-(9-羟基-4,6,8,10-四甲基-7-氧代十二碳-4-烯-2-基)-3-甲基氧杂环丁烷-2-酮
The XLogP value of 4.6 indicates that 4-(9-羟基-4,6,8,10-四甲基-7-氧代十二碳-4-烯-2-基)-3-甲基氧杂环丁烷-2-酮 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(9-羟基-4,6,8,10-四甲基-7-氧代十二碳-4-烯-2-基)-3-甲基氧杂环丁烷-2-酮. Following Lipinski's Rule of Five, 4-(9-羟基-4,6,8,10-四甲基-7-氧代十二碳-4-烯-2-基)-3-甲基氧杂环丁烷-2-酮 has 1 hydrogen bond donor(s) and 4 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 4-(9-羟基-4,6,8,10-四甲基-7-氧代十二碳-4-烯-2-基)-3-甲基氧杂环丁烷-2-酮?
The CAS number of 4-(9-羟基-4,6,8,10-四甲基-7-氧代十二碳-4-烯-2-基)-3-甲基氧杂环丁烷-2-酮 is 76808-16-7.
What is the molecular formula of 4-(9-羟基-4,6,8,10-四甲基-7-氧代十二碳-4-烯-2-基)-3-甲基氧杂环丁烷-2-酮?
The molecular formula of 4-(9-羟基-4,6,8,10-四甲基-7-氧代十二碳-4-烯-2-基)-3-甲基氧杂环丁烷-2-酮 is C20H34O4.
What is the molecular weight of 4-(9-羟基-4,6,8,10-四甲基-7-氧代十二碳-4-烯-2-基)-3-甲基氧杂环丁烷-2-酮?
The molecular weight of 4-(9-羟基-4,6,8,10-四甲基-7-氧代十二碳-4-烯-2-基)-3-甲基氧杂环丁烷-2-酮 is 338.25 g/mol.
Where can I buy 4-(9-羟基-4,6,8,10-四甲基-7-氧代十二碳-4-烯-2-基)-3-甲基氧杂环丁烷-2-酮?
You can request a quote for 4-(9-羟基-4,6,8,10-四甲基-7-氧代十二碳-4-烯-2-基)-3-甲基氧杂环丁烷-2-酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(9-羟基-4,6,8,10-四甲基-7-氧代十二碳-4-烯-2-基)-3-甲基氧杂环丁烷-2-酮?
Yes, KEHONG BIO provides custom synthesis services for 4-(9-羟基-4,6,8,10-四甲基-7-氧代十二碳-4-烯-2-基)-3-甲基氧杂环丁烷-2-酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.