이름: Ethyl 6-(benzo[d]thiazol-6-ylamino)-4-(isopropylamino)nicotinate
SMILES:
CCOC(=O)c1cnc(Nc2ccc3ncsc3c2)cc1NC(C)CMolecular Processing
Molecular formula
C18H20N4O2S
Molecular weight
356.45
Exact mass
356.1307
XLogP
4.43
TPSA
76.14
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
25
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.278
Molar refractivity
101.85
Supplementary Information
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