(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)(1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)methanone
Chemical Structure Depiction of
(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)(1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)methanone
(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)(1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)methanone
Compound characteristics
| Compound ID: | Y042-5317 |
| Compound Name: | (3,4-dihydro-2H-1,5-benzodioxepin-7-yl)(1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)methanone |
| Molecular Weight: | 348.4 |
| Molecular Formula: | C21 H20 N2 O3 |
| Smiles: | C1COc2ccc(cc2OC1)C(N1CCc2c(C1)c1ccccc1[nH]2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8835 |
| logD: | 1.8835 |
| logSw: | -2.7969 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.553 |
| InChI Key: | PNUZHQSHKQIBAH-UHFFFAOYSA-N |