5-bromo-N-(3-methoxyphenyl)-2-(pyrrolidin-1-yl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-bromo-N-(3-methoxyphenyl)-2-(pyrrolidin-1-yl)pyrimidine-4-carboxamide
5-bromo-N-(3-methoxyphenyl)-2-(pyrrolidin-1-yl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | 8019-6142 |
| Compound Name: | 5-bromo-N-(3-methoxyphenyl)-2-(pyrrolidin-1-yl)pyrimidine-4-carboxamide |
| Molecular Weight: | 377.24 |
| Molecular Formula: | C16 H17 Br N4 O2 |
| Smiles: | COc1cccc(c1)NC(c1c(cnc(n1)N1CCCC1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.4438 |
| logD: | 3.4426 |
| logSw: | -3.5747 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.482 |
| InChI Key: | DIHVSULOHPSZJW-UHFFFAOYSA-N |