CC(C)C(=O)NC1=CC=CC(=C1)C2CCN(CC2)CCC(C3=CC=CC=C3)NC(=O)NC4=CC=CC=C4SC
الاسم: 2-methyl-N-[3-[1-[3-[(2-methylsulfanylphenyl)carbamoylamino]-3-phenylpropyl]piperidin-4-yl]phenyl]propanamide
SMILES: CC(C)C(=O)NC1=CC=CC(=C1)C2CCN(CC2)CCC(C3=CC=CC=C3)NC(=O)NC4=CC=CC=C4SC

Molecular Processing

Molecular formula
C32H40N4O2S
Molecular weight
544.77
Exact mass
544.2872
XLogP
7.14
TPSA
73.47
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
10
Heavy atoms
39
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
162.5

Supplementary Information

InChIKey: RCVHSJQUGYNPNV-UHFFFAOYSA-N
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