KBio2_004303
TL;DR: KBio2_004303 (CAS 52811-61-7) is a chemical compound with molecular formula C18H30O2 and molecular weight 278.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-4-(2-hydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)but-3-en-2-one
Also Known As: KBio2_004303, 15,16-Bis-nor-labd-11-en-13-on-8-ol, BAS 13119517, (3E)-4-(2-hydroxy-2,5,5,8a-tetramethyldecahydronaphthalen-1-yl)but-3-en-2-one, (E)-4-(2-hydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)but-3-en-2-one
| Molecular Formula | C18H30O2 |
|---|---|
| Molecular Weight | 278.22 g/mol |
| LogP | 4.1252 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 278.22458 |
| Heavy Atoms | 20 |
| Complexity | 419.13416 |
Chemical Identifiers
| CAS Number | 52811-61-7 |
|---|---|
| SMILES | CC(=O)/C=C/C1C2(CCCC(C2CCC1(C)O)(C)C)C |
Product Overview
KBio2_004303 (CAS 52811-61-7), with molecular formula C18H30O2 and molecular weight 278.22 g/mol. IUPAC: (E)-4-(2-hydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)but-3-en-2-one.
Chemical Property Profile of KBio2_004303
Property Insights of KBio2_004303
The XLogP value of 4.1252 indicates that KBio2_004303 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, KBio2_004303 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, KBio2_004303 has 1 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 KBio2_004303?
The CAS number of KBio2_004303 is 52811-61-7.
What is the molecular formula of KBio2_004303?
The molecular formula of KBio2_004303 is C18H30O2.
What is the molecular weight of KBio2_004303?
The molecular weight of KBio2_004303 is 278.22 g/mol.
Where can I buy KBio2_004303?
You can request a quote for KBio2_004303 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KBio2_004303?
Yes, KEHONG BIO provides custom synthesis services for KBio2_004303 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.