RefChem:1065267
TL;DR: RefChem:1065267 (CAS 37391-18-7) is a chemical compound with molecular formula C27H32N2O5 and molecular weight 464.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-4-hydroxy-4-oxobut-2-enoate;3-methyl-3-phenyl-1-(3-piperidin-1-ium-1-ylpropyl)indol-2-one
Also Known As: 2H-Indol-2-one, 1,3-dihydro-3-methyl-3-phenyl-1-(3-(piperidino)propyl)-, maleate (1:1), 1,3-Dihydro-3-methyl-3-phenyl-1-(3-(piperidino)propyl)-2H-indol-2-one maleate, 2H-INDOL-2-ONE, 1,3-DIHYDRO-3-METHYL-3-PHENYL-1-(3-(PIPERIDINO)PROPYL)-, MALEATE, (Z)-4-hydroxy-4-oxobut-2-enoate; 3-methyl-3-phenyl-1-(3-piperidin-1-ium-1-ylpropyl)indol-2-one, RefChem:1065267
| Molecular Formula | C27H32N2O5 |
|---|---|
| Molecular Weight | 464.23 g/mol |
| LogP | 1.1752 |
| Topological Polar Surface Area | 102.18 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 464.2311 |
| Heavy Atoms | 34 |
| Complexity | 1014.3258 |
Chemical Identifiers
| CAS Number | 37391-18-7 |
|---|---|
| SMILES | CC1(C2=CC=CC=C2N(C1=O)CCC[NH+]3CCCCC3)C4=CC=CC=C4.C(=C\C(=O)[O-])\C(=O)O |
Product Overview
RefChem:1065267 (CAS 37391-18-7), with molecular formula C27H32N2O5 and molecular weight 464.23 g/mol. IUPAC: (Z)-4-hydroxy-4-oxobut-2-enoate;3-methyl-3-phenyl-1-(3-piperidin-1-ium-1-ylpropyl)indol-2-one.
Chemical Property Profile of RefChem:1065267
Property Insights of RefChem:1065267
The XLogP value of 1.1752 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1065267. The TPSA of 102.18 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1065267. Following Lipinski's Rule of Five, RefChem:1065267 has 2 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 RefChem:1065267?
The CAS number of RefChem:1065267 is 37391-18-7.
What is the molecular formula of RefChem:1065267?
The molecular formula of RefChem:1065267 is C27H32N2O5.
What is the molecular weight of RefChem:1065267?
The molecular weight of RefChem:1065267 is 464.23 g/mol.
Where can I buy RefChem:1065267?
You can request a quote for RefChem:1065267 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1065267?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1065267 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.