BAS 01074240
TL;DR: BAS 01074240 (CAS 334504-66-4) is a chemical compound with molecular formula C21H25NO4 and molecular weight 355.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,5,5-trimethyl-8-methylidene-1,2,4,6,7,8a-hexahydroazulen-6-yl) 4-nitrobenzoate
Also Known As: BAS 01074240, 3,5,5-trimethyl-8-methylene-1,2,4,5,6,7,8,8a-octahydroazulen-6-yl 4-nitrobenzoate, 3,5,5-trimethyl-8-methylidene-1,2,4,5,6,7,8,8a-octahydroazulen-6-yl 4-nitrobenzoate, (3,5,5-trimethyl-8-methylidene-1,2,4,6,7,8a-hexahydroazulen-6-yl) 4-nitrobenzoate, 3,5,5-trimethyl-8-methylene-1,2,4,5,6,7,8a-heptahydroazulen-6-yl 4-nitrobenzoa te
| Molecular Formula | C21H25NO4 |
|---|---|
| Molecular Weight | 355.18 g/mol |
| LogP | 5.2229 |
| Topological Polar Surface Area | 69.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 355.17834 |
| Heavy Atoms | 26 |
| Complexity | 788.734 |
Chemical Identifiers
| CAS Number | 334504-66-4 |
|---|---|
| SMILES | CC1=C2CC(C(CC(=C)C2CC1)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-])(C)C |
Product Overview
BAS 01074240 (CAS 334504-66-4), with molecular formula C21H25NO4 and molecular weight 355.18 g/mol. IUPAC: (3,5,5-trimethyl-8-methylidene-1,2,4,6,7,8a-hexahydroazulen-6-yl) 4-nitrobenzoate.
Chemical Property Profile of BAS 01074240
Property Insights of BAS 01074240
The XLogP value of 5.2229 indicates that BAS 01074240 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.44 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01074240. Following Lipinski's Rule of Five, BAS 01074240 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01074240?
The CAS number of BAS 01074240 is 334504-66-4.
What is the molecular formula of BAS 01074240?
The molecular formula of BAS 01074240 is C21H25NO4.
What is the molecular weight of BAS 01074240?
The molecular weight of BAS 01074240 is 355.18 g/mol.
Where can I buy BAS 01074240?
You can request a quote for BAS 01074240 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01074240?
Yes, KEHONG BIO provides custom synthesis services for BAS 01074240 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.