RefChem:1056480
TL;DR: RefChem:1056480 (CAS 4925-64-8) is a chemical compound with molecular formula C23H24N2O5S and molecular weight 440.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-but-2-enedioic acid;4-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine-1-carbaldehyde
Also Known As: 10-(4-Formylpiperazino)-10,11-dihydrodibenzo(b,f)thiepin hydrogen maleate, 1-Piperazinecarboxaldehyde, 4-(10,11-dihydrodibenzo(b,f)thiepin-10-yl)-, maleate (1:1), 4-(10,11-Dihydrodibenzo(b,f)thiepin-10-yl)-1-piperazinecarboxaldehyde maleate, (Z)-but-2-enedioic acid; 4-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine-1-carbaldehyde, RefChem:1056480
| Molecular Formula | C23H24N2O5S |
|---|---|
| Molecular Weight | 440.14 g/mol |
| LogP | 2.9208 |
| Topological Polar Surface Area | 98.15 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 440.1406 |
| Heavy Atoms | 31 |
| Complexity | 953.9441 |
Chemical Identifiers
| CAS Number | 4925-64-8 |
|---|---|
| SMILES | C1CN(CCN1C=O)C2CC3=CC=CC=C3SC4=CC=CC=C24.C(=C\C(=O)O)\C(=O)O |
Product Overview
RefChem:1056480 (CAS 4925-64-8), with molecular formula C23H24N2O5S and molecular weight 440.14 g/mol. IUPAC: (Z)-but-2-enedioic acid;4-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine-1-carbaldehyde.
Chemical Property Profile of RefChem:1056480
Property Insights of RefChem:1056480
The XLogP value of 2.9208 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1056480. The TPSA of 98.15 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1056480. Following Lipinski's Rule of Five, RefChem:1056480 has 2 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:1056480?
The CAS number of RefChem:1056480 is 4925-64-8.
What is the molecular formula of RefChem:1056480?
The molecular formula of RefChem:1056480 is C23H24N2O5S.
What is the molecular weight of RefChem:1056480?
The molecular weight of RefChem:1056480 is 440.14 g/mol.
Where can I buy RefChem:1056480?
You can request a quote for RefChem:1056480 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1056480?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1056480 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.