ChemDiv1_003078
TL;DR: ChemDiv1_003078 (CAS 345950-91-6) is a chemical compound with molecular formula C26H32N2O4 and molecular weight 436.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,12-dicyclohexyl-5,12-diazapentacyclo[7.5.2.02,8.03,7.010,14]hexadec-15-ene-4,6,11,13-tetrone
Also Known As: ChemDiv1_003078, BAS 01217075, A2205/0092838, 2,6-dicyclohexyl-4,4a,7a,8,8a,8b-hexahydro-4,8-ethenopyrrolo[3',4':3,4]cyclobuta[1,2-f]isoindole-1,3,5,7(2H,3aH,3bH,6H)-tetraone, 2,6-dicyclohexyloctahydro-4,8-ethenopyrrolo[3',4':3,4]cyclobuta[1,2-f]isoindole-1,3,5,7(2H,6H)-tetrone
| Molecular Formula | C26H32N2O4 |
|---|---|
| Molecular Weight | 436.24 g/mol |
| LogP | 2.916 |
| Topological Polar Surface Area | 74.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 436.2362 |
| Heavy Atoms | 32 |
| Complexity | 874.1114 |
Chemical Identifiers
| CAS Number | 345950-91-6 |
|---|---|
| SMILES | C1CCC(CC1)N2C(=O)C3C4C=CC(C3C2=O)C5C4C6C5C(=O)N(C6=O)C7CCCCC7 |
Product Overview
ChemDiv1_003078 (CAS 345950-91-6), with molecular formula C26H32N2O4 and molecular weight 436.24 g/mol. IUPAC: 5,12-dicyclohexyl-5,12-diazapentacyclo[7.5.2.02,8.03,7.010,14]hexadec-15-ene-4,6,11,13-tetrone.
Chemical Property Profile of ChemDiv1_003078
Property Insights of ChemDiv1_003078
The XLogP value of 2.916 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_003078. The TPSA of 74.76 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_003078. Following Lipinski's Rule of Five, ChemDiv1_003078 has 0 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 ChemDiv1_003078?
The CAS number of ChemDiv1_003078 is 345950-91-6.
What is the molecular formula of ChemDiv1_003078?
The molecular formula of ChemDiv1_003078 is C26H32N2O4.
What is the molecular weight of ChemDiv1_003078?
The molecular weight of ChemDiv1_003078 is 436.24 g/mol.
Where can I buy ChemDiv1_003078?
You can request a quote for ChemDiv1_003078 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_003078?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_003078 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.