Batebulast
TL;DR: Batebulast (CAS 81907-78-0) is a chemical compound with molecular formula C19H29N3O2 and molecular weight 331.22598 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-tert-butylphenyl) 4-[(diaminomethylideneamino)methyl]cyclohexane-1-carboxylate
Also Known As: Batebulast, Batebulast [INN], GMCHA-OPhBu, GMCHA-OPhBu(t), Nco 650
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C19H29N3O2 |
| Molecular Weight | 331.22598 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 90.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 331.22598 Da |
| Heavy Atoms | 24 |
| Complexity | 436.0 |
| SMILES | CC(C)(C)C1=CC=C(C=C1)OC(=O)C2CCC(CC2)CN=C(N)N |
| InChIKey | HXLJIJAWKVNQNT-UHFFFAOYSA-N |
Chemical Property Profile of Batebulast
Property Insights of Batebulast
The XLogP value of 3.2 indicates that Batebulast is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Batebulast. Following Lipinski's Rule of Five, Batebulast has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Batebulast?
The CAS number of Batebulast is 81907-78-0.
What is the molecular formula of Batebulast?
The molecular formula of Batebulast is C19H29N3O2.
What is the molecular weight of Batebulast?
The molecular weight of Batebulast is 331.22598 g/mol.
Where can I buy Batebulast?
You can request a quote for Batebulast directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Batebulast?
Yes, CoreyChem provides custom synthesis services for Batebulast and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.