이름: tert-butyl 2-[({[1-(2-pyridinyl)-4-piperidinyl]amino}carbonyl)amino]ethylcarbamate
SMILES:
CC(C)(C)OC(=O)NCCNC(=O)NC1CCN(c2ccccn2)CC1Molecular Processing
Molecular formula
C18H29N5O3
Molecular weight
363.46
Exact mass
363.227
XLogP
1.87
TPSA
95.59
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
26
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.611
Molar refractivity
100.24
Supplementary Information
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