trivial
Nitrosoprodenafil
systemic
2-[(5-[5-(3,5-Dimethylpiperazine-1-sulfonyl)-2-ethoxyphenyl]-1-methyl-3-propyl-1'H'-pyrazolo[4,3-d]pyrimidin-7-yl)oxy]-'N'-methyl-'N'-nitroso-1,3-thiazol-5-amine
Nitrosoprodenafil
systemic
2-[(5-[5-(3,5-Dimethylpiperazine-1-sulfonyl)-2-ethoxyphenyl]-1-methyl-3-propyl-1'H'-pyrazolo[4,3-d]pyrimidin-7-yl)oxy]-'N'-methyl-'N'-nitroso-1,3-thiazol-5-amine
Identifiers
InChIKey: DTAKXJYYAUWRND-CALCHBBNSA-N
Formula: C27H35N9O5S2
CAS Registry numbers:
1266755-08-1
Descriptors
Bioavailability-related
Molecular weight: 629.22 DaPartition coefficient: 4.12
H bond donors: 1
H bond acceptors: 14
Rotatable bonds: 11
Molar refractivity: 164.11 J mol-1 K-1
Polar surface area: 157.03 Å2
Generic
Stereocenters: 2Heteroatoms: 16
Spiroatoms: 0
Bridge atoms: 0
Amide bonds: 0
Ring-related
Rings: 5Heterocycles: 4
Aromatic rings: 4
Aromatic carbocycles: 1
Aromatic heterocycles: 3
Aliphatic rings: 1
Aliphatic carbocycles: 0
Aliphatic heterocycles: 1