Name: 8-Amino-4-cyclopropylmethyl-7-methoxy-1-methyl-1,3,4,5-tetrahydro-benzo[e][1,4]diazepin-2-one
SMILES:
COc1cc2c(cc1N)N(C)C(=O)CN(CC1CC1)C2Molecular Processing
Molecular formula
C15H21N3O2
Molecular weight
275.35
Exact mass
275.1634
XLogP
1.47
TPSA
58.8
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
20
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.533
Molar refractivity
78.82
Supplementary Information
Details werden geladen…
An 7 Reaktionen beteiligt→