(5S)-N-benzyl-5-[(5-bromopyridine-3-carbonyl)amino]-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-2-carboxamide
Chemical Structure Depiction of
(5S)-N-benzyl-5-[(5-bromopyridine-3-carbonyl)amino]-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-2-carboxamide
(5S)-N-benzyl-5-[(5-bromopyridine-3-carbonyl)amino]-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-2-carboxamide
Compound characteristics
Compound ID: | SB70-0806 |
Compound Name: | (5S)-N-benzyl-5-[(5-bromopyridine-3-carbonyl)amino]-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-2-carboxamide |
Molecular Weight: | 440.3 |
Molecular Formula: | C20 H18 Br N5 O2 |
Smiles: | C1c2cc(C(NCc3ccccc3)=O)nn2C[C@H]1NC(c1cc(cnc1)[Br])=O |
Stereo: | ABSOLUTE |
logP: | 2.1746 |
logD: | 2.1746 |
logSw: | -2.6219 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 72.235 |
InChI Key: | NAKNRGIAZPKMQE-INIZCTEOSA-N |