(3R)-4-(2,3-dihydro-1H-indene-5-sulfonyl)-3-methyl-7-(pyrimidin-5-yl)-2,3,4,5-tetrahydro-1,4-benzoxazepine
Chemical Structure Depiction of
(3R)-4-(2,3-dihydro-1H-indene-5-sulfonyl)-3-methyl-7-(pyrimidin-5-yl)-2,3,4,5-tetrahydro-1,4-benzoxazepine
(3R)-4-(2,3-dihydro-1H-indene-5-sulfonyl)-3-methyl-7-(pyrimidin-5-yl)-2,3,4,5-tetrahydro-1,4-benzoxazepine
Compound characteristics
| Compound ID: | SC09-0349 |
| Compound Name: | (3R)-4-(2,3-dihydro-1H-indene-5-sulfonyl)-3-methyl-7-(pyrimidin-5-yl)-2,3,4,5-tetrahydro-1,4-benzoxazepine |
| Molecular Weight: | 421.52 |
| Molecular Formula: | C23 H23 N3 O3 S |
| Smiles: | C[C@@H]1COc2ccc(cc2CN1S(c1ccc2CCCc2c1)(=O)=O)c1cncnc1 |
| Stereo: | ABSOLUTE |
| logP: | 3.9422 |
| logD: | 3.9422 |
| logSw: | -3.8508 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.218 |
| InChI Key: | ZNBFLWNNXPWSIO-MRXNPFEDSA-N |