2-(1,3-benzothiazol-2-yl)-4-methyl-1-[(3-methylphenyl)methyl]-5-[3-(morpholin-4-yl)propyl]-1H-pyrazolo[4,3-c]pyridine-3,6(2H,5H)-dione
Chemical Structure Depiction of
2-(1,3-benzothiazol-2-yl)-4-methyl-1-[(3-methylphenyl)methyl]-5-[3-(morpholin-4-yl)propyl]-1H-pyrazolo[4,3-c]pyridine-3,6(2H,5H)-dione
2-(1,3-benzothiazol-2-yl)-4-methyl-1-[(3-methylphenyl)methyl]-5-[3-(morpholin-4-yl)propyl]-1H-pyrazolo[4,3-c]pyridine-3,6(2H,5H)-dione
Compound characteristics
Compound ID: | Y600-2599 |
Compound Name: | 2-(1,3-benzothiazol-2-yl)-4-methyl-1-[(3-methylphenyl)methyl]-5-[3-(morpholin-4-yl)propyl]-1H-pyrazolo[4,3-c]pyridine-3,6(2H,5H)-dione |
Molecular Weight: | 529.66 |
Molecular Formula: | C29 H31 N5 O3 S |
Smiles: | CC1=C2C(=CC(N1CCCN1CCOCC1)=O)N(Cc1cccc(C)c1)N(C2=O)c1nc2ccccc2s1 |
Stereo: | ACHIRAL |
logP: | 4.0684 |
logD: | 3.6164 |
logSw: | -4.0431 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 56.123 |
InChI Key: | GDODCCPBPFSXIK-UHFFFAOYSA-N |