4-iodo-1-methyl-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
4-iodo-1-methyl-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-1H-pyrazole-5-carboxamide
4-iodo-1-methyl-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y500-3001 |
| Compound Name: | 4-iodo-1-methyl-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 409.18 |
| Molecular Formula: | C15 H12 I N3 O3 |
| Smiles: | CC1=CC(=O)Oc2cc(ccc12)NC(c1c(cnn1C)I)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3382 |
| logD: | 2.2602 |
| logSw: | -3.1487 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.253 |
| InChI Key: | GJEQOPBXTLRVNT-UHFFFAOYSA-N |