N-cyclopropyl-N'-ethyl-N-[9-(isoquinoline-1-carbonyl)-1-oxa-9-azaspiro[5.5]undecan-4-yl]urea
Chemical Structure Depiction of
N-cyclopropyl-N'-ethyl-N-[9-(isoquinoline-1-carbonyl)-1-oxa-9-azaspiro[5.5]undecan-4-yl]urea
N-cyclopropyl-N'-ethyl-N-[9-(isoquinoline-1-carbonyl)-1-oxa-9-azaspiro[5.5]undecan-4-yl]urea
Compound characteristics
| Compound ID: | S543-0400 |
| Compound Name: | N-cyclopropyl-N'-ethyl-N-[9-(isoquinoline-1-carbonyl)-1-oxa-9-azaspiro[5.5]undecan-4-yl]urea |
| Molecular Weight: | 436.55 |
| Molecular Formula: | C25 H32 N4 O3 |
| Smiles: | CCNC(N(C1CC1)C1CCOC2(CCN(CC2)C(c2c3ccccc3ccn2)=O)C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.73 |
| logD: | 2.7298 |
| logSw: | -2.973 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.751 |
| InChI Key: | QWQUMLOXUYEHTO-FQEVSTJZSA-N |