C1C2=CC=CC=C2N(CC3=CC=CN31)C(=O)C4=CC=C(C=C4)N
Название: (4-aminophenyl)-(6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepin-5-yl)methanone
SMILES: C1C2=CC=CC=C2N(CC3=CC=CN31)C(=O)C4=CC=C(C=C4)N

Molecular Processing

Molecular formula
C19H17N3O
Molecular weight
303.37
Exact mass
303.1372
XLogP
3.28
TPSA
51.26
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
23
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.105
Molar refractivity
91.34

Supplementary Information

InChIKey: MSWOGZZRHMRJAK-UHFFFAOYSA-N
Синонимы
10,11-dihydro-10-(4-aminobenzoyl)-5H-pyrrolo(2,1-c][1,4]benzodiazepine10,11-dihydro-10-(4-aminobenzoyl)-5H-pyrrolo[2,1-c][1,4]benzodiazepineSCHEMBL5738429MSWOGZZRHMRJAK-UHFFFAOYSA-N10,11-dihydro-10(4-aminobenzoyl)-5H-pyrrolo[2,1-c][1,4]benzodiazepine10,11-dihydro-10-(4- aminobenzoyl)-5H-pyrrolo[2,1-c][1,4]benzodiazepine10,11-dihydro-10-(4-amino-benzoyl)-5H-pyrrolo[2,1-c][1,4]benzodiazepine10,11-dihydro-10-(4-aminobenzoyl)-5H-pyrrolo-[2,1-c][1,4]benzodiazepine10,11-dihydro-10-(4-aminobenzoyl)-5H-pyrrolo[2,1-c]-[1,4]benzodiazepine10,11-dihydro-10-(4-aminobenzoyl)-5H-pyrrolo[2,1-c][1,4-]benzodiazepine10,11-dihydro-10-(4-aminobenzoyl)-5H-pyrrolo[2,1-c][1,4]-benzodiazepine10,11-Dihydro-10-(4-aminobenzoyl)-5H-pyrrolo[2,1-c][1,41benzodiazepine10, 11-dihydro-10-(4-aminobenzoyl)-5H-pyrrolo-[2,1-c][1,4]benzodiazepine10, 11-dihydro-10-(4-aminobenzoyl)-5H-pyrrolo[2, 1-c][1,4]benzodiazepine10,11-dihydro-10-(4-aminobenzoyl) -5H-pyrrolo[2, 1-c][1,4]-benzodiazepine
Источник
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