이름: 5-chloro-2-ethyl-7-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one
SMILES:
CCN1C2=C(C=CC=N2)C(=O)NC3=C1N=C(C=C3C)ClMolecular Processing
Molecular formula
C14H13ClN4O
Molecular weight
288.74
Exact mass
288.0778
XLogP
3.16
TPSA
58.12
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
20
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.214
Molar refractivity
78.85
Supplementary Information
InChIKey: CXJPWCNKFIWDQB-UHFFFAOYSA-N
동의어
Dipyridodiazepinone deriv. 15BDBM1528CHEMBL142837SCHEMBL8303477CXJPWCNKFIWDQB-UHFFFAOYSA-N2-chloro-11-ethyl-4-methyl-5H-dipyrido[[?],[?]][1,4]diazepin-6-one2-Chloro-11-ethyl-4-methyl-5,11-dihydro-6H-dipyrido[2,3-e:3',2'-b][1,4]diazepin-6-one2-chloro-5,11-dihydro-11-ethyl-4 -methyl-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one2-chloro-5,11-dihydro-11-ethyl-4-methyl-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one2-chloro-5,11-dihydro-11l-ethyl-4-methyl-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one5-chloro-2-ethyl-7-methyl-2,4,9,15-tetraazatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3,5,7,12,14-hexaen-10-one
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