TL;DR: ISONICOTINIC ACID 3-THUJYLIDENEHYDRAZIDE (CAS 15885-67-3) is a chemical compound with molecular formula C16H21N3O and molecular weight 271.16846 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(4-methyl-1-propan-2-yl-3-bicyclo[3.1.0]hexanylidene)amino]pyridine-4-carboxamide
Also Known As: ISONICOTINIC ACID 3-THUJYLIDENEHYDRAZIDE
| Molecular Formula | C16H21N3O |
| Molecular Weight | 271.16846 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 271.16846 Da |
| Heavy Atoms | 20 |
| Complexity | 425.0 |
| SMILES | CC1C2CC2(CC1=NNC(=O)C3=CC=NC=C3)C(C)C |
| InChIKey | IAYJZKYEROTTON-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ISONICOTINIC ACID 3-THUJYLIDENEHYDRAZIDE. With a topological polar surface area (TPSA) of 54.4 Ų, ISONICOTINIC ACID 3-THUJYLIDENEHYDRAZIDE exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ISONICOTINIC ACID 3-THUJYLIDENEHYDRAZIDE has 1 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 ISONICOTINIC ACID 3-THUJYLIDENEHYDRAZIDE is 15885-67-3.
The molecular formula of ISONICOTINIC ACID 3-THUJYLIDENEHYDRAZIDE is C16H21N3O.
The molecular weight of ISONICOTINIC ACID 3-THUJYLIDENEHYDRAZIDE is 271.16846 g/mol.
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