TL;DR: 4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(1-piperidinyl)- (CAS 137731-11-4) is a chemical compound with molecular formula C15H17N5 and molecular weight 267.1484 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-piperidin-1-yl-4H-[1,2,4]triazolo[4,3-a][1,5]benzodiazepine
Also Known As: 4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(1-piperidinyl)-, 5-(1-Piperidinyl)-4H-(1,2,4)triazolo(4,3-a)(1,5)benzodiazepine, 5-Piperidino-4H-[1,2,4]triazolo[4,3-a][1,5]benzodiazepine, 5-piperidin-1-yl-4H-[1,2,4]triazolo[4,3-a][1,5]benzodiazepine, 5-(Piperidin-1-yl)-4H-[1,2,4]triazolo[4,3-a][1,5]benzodiazepine
| Molecular Formula | C15H17N5 |
| Molecular Weight | 267.1484 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 46.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 267.1484 Da |
| Heavy Atoms | 20 |
| Complexity | 376.0 |
| SMILES | C1CCN(CC1)C2=NC3=CC=CC=C3N4C=NN=C4C2 |
| InChIKey | JNRVXWFZWNKIHP-UHFFFAOYSA-N |
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(1-piperidinyl)-. With a topological polar surface area (TPSA) of 46.3 Ų, 4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(1-piperidinyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(1-piperidinyl)- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(1-piperidinyl)- is 137731-11-4.
The molecular formula of 4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(1-piperidinyl)- is C15H17N5.
The molecular weight of 4H-(1,2,4)Triazolo(4,3-a)(1,5)benzodiazepine, 5-(1-piperidinyl)- is 267.1484 g/mol.
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