N-(3-chloro-4-methoxyphenyl)-4-ethyl-9-oxo-1,2,3,3a,4,9-hexahydropyrrolo[2,1-b]quinazoline-6-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-4-ethyl-9-oxo-1,2,3,3a,4,9-hexahydropyrrolo[2,1-b]quinazoline-6-carboxamide
N-(3-chloro-4-methoxyphenyl)-4-ethyl-9-oxo-1,2,3,3a,4,9-hexahydropyrrolo[2,1-b]quinazoline-6-carboxamide
Compound characteristics
| Compound ID: | S411-0055 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-4-ethyl-9-oxo-1,2,3,3a,4,9-hexahydropyrrolo[2,1-b]quinazoline-6-carboxamide |
| Molecular Weight: | 399.88 |
| Molecular Formula: | C21 H22 Cl N3 O3 |
| Smiles: | CCN1C2CCCN2C(c2ccc(cc12)C(Nc1ccc(c(c1)[Cl])OC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4237 |
| logD: | 3.4233 |
| logSw: | -3.9004 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.335 |
| InChI Key: | RUZRFPIDYGCAPK-LJQANCHMSA-N |