N-[(5-methylfuran-2-yl)methyl]-1-propyl-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-[(5-methylfuran-2-yl)methyl]-1-propyl-1H-benzotriazole-5-carboxamide
N-[(5-methylfuran-2-yl)methyl]-1-propyl-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | F058-2141 |
| Compound Name: | N-[(5-methylfuran-2-yl)methyl]-1-propyl-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 298.34 |
| Molecular Formula: | C16 H18 N4 O2 |
| Smiles: | CCCn1c2ccc(cc2nn1)C(NCc1ccc(C)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.64 |
| logD: | 2.64 |
| logSw: | -2.8503 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.591 |
| InChI Key: | CWGVDQMXRKURIR-UHFFFAOYSA-N |