RefChem:1056623
TL;DR: RefChem:1056623 (CAS 51490-33-6) is a chemical compound with molecular formula C22H32N2O5 and molecular weight 404.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-2-methylbut-2-enedioic acid;2-[4-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-3-yl)piperazin-1-yl]ethanol
Also Known As: 2-(4-(2-Hydroxypropyl)piperazino)-6,7,8,9-tetrahydro-5H-benzocycloheptene maleate, 1-Piperazineethanol, alpha-methyl-4-(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)-, (Z)-2-butenedioate (1:1), alpha-Methyl-4-(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)-1-piperazineethanol maleate, (Z)-2-methylbut-2-enedioic acid; 2-[4-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-3-yl)piperazin-1-yl]ethanol, RefChem:1056623
| Molecular Formula | C22H32N2O5 |
|---|---|
| Molecular Weight | 404.23 g/mol |
| LogP | 2.1717 |
| Topological Polar Surface Area | 101.31 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 404.2311 |
| Heavy Atoms | 29 |
| Complexity | 723.91284 |
Chemical Identifiers
| CAS Number | 51490-33-6 |
|---|---|
| SMILES | C/C(=C/C(=O)O)/C(=O)O.C1CCC2=C(CC1)C=C(C=C2)N3CCN(CC3)CCO |
Product Overview
RefChem:1056623 (CAS 51490-33-6), with molecular formula C22H32N2O5 and molecular weight 404.23 g/mol. IUPAC: (Z)-2-methylbut-2-enedioic acid;2-[4-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-3-yl)piperazin-1-yl]ethanol.
Chemical Property Profile of RefChem:1056623
Property Insights of RefChem:1056623
The XLogP value of 2.1717 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1056623. The TPSA of 101.31 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1056623. Following Lipinski's Rule of Five, RefChem:1056623 has 3 hydrogen bond donor(s) and 5 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:1056623?
The CAS number of RefChem:1056623 is 51490-33-6.
What is the molecular formula of RefChem:1056623?
The molecular formula of RefChem:1056623 is C22H32N2O5.
What is the molecular weight of RefChem:1056623?
The molecular weight of RefChem:1056623 is 404.23 g/mol.
Where can I buy RefChem:1056623?
You can request a quote for RefChem:1056623 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1056623?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1056623 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.