BATELAPINE MALEATE
TL;DR: BATELAPINE MALEATE (CAS 120360-10-3) is a chemical compound with molecular formula C20H24N6O4 and molecular weight 412.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
but-2-enedioic acid;2-methyl-5-(4-methylpiperazin-1-yl)-11H-[1,2,4]triazolo[1,5-c][1,3]benzodiazepine
Also Known As: BATELAPINE MALEATE, Batelapine maleate [USAN], 11H-(1,2,4)Triazolo(1,5-c)(1,3)benzodiazepine, 2-methyl-5-(4-methyl-1-piperazinyl)-, (Z)-2-butenedioate (1:1), 2-Methyl-5-(4-methyl-1-piperazinyl)-11H-s-triazolo(1,5-c)(1,3)benzodiazepine maleate (1:1)
| Molecular Formula | C20H24N6O4 |
|---|---|
| Molecular Weight | 412.19 g/mol |
| LogP | 0.99 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 412.1859 |
| Heavy Atoms | 30 |
| Complexity | 549.0 |
Chemical Identifiers
| CAS Number | 120360-10-3 |
|---|---|
| SMILES | CC1=NN2C(=N1)CC3=CC=CC=C3N=C2N4CCN(CC4)C.C(=CC(=O)O)C(=O)O |
| InChIKey | UNBBRTKPRZDYLP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
BATELAPINE MALEATE (CAS 120360-10-3), with molecular formula C20H24N6O4 and molecular weight 412.19 g/mol. IUPAC: but-2-enedioic acid;2-methyl-5-(4-methylpiperazin-1-yl)-11H-[1,2,4]triazolo[1,5-c][1,3]benzodiazepine.
Chemical Property Profile of BATELAPINE MALEATE
Property Insights of BATELAPINE MALEATE
The XLogP value of 0.99 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BATELAPINE MALEATE. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BATELAPINE MALEATE. Following Lipinski's Rule of Five, BATELAPINE MALEATE has 2 hydrogen bond donor(s) and 8 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 BATELAPINE MALEATE?
The CAS number of BATELAPINE MALEATE is 120360-10-3.
What is the molecular formula of BATELAPINE MALEATE?
The molecular formula of BATELAPINE MALEATE is C20H24N6O4.
What is the molecular weight of BATELAPINE MALEATE?
The molecular weight of BATELAPINE MALEATE is 412.19 g/mol.
Where can I buy BATELAPINE MALEATE?
You can request a quote for BATELAPINE MALEATE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BATELAPINE MALEATE?
Yes, KEHONG BIO provides custom synthesis services for BATELAPINE MALEATE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.