C1CCC2(CC1)C(=O)OC(=N2)C3=CC4=CC=CC=C4S3
CAS: 944282-06-8
Name: 2-(1-benzothiophen-2-yl)-3-oxa-1-azaspiro[4.5]dec-1-en-4-one
SMILES: C1CCC2(CC1)C(=O)OC(=N2)C3=CC4=CC=CC=C4S3

Molecular Processing

Molecular formula
C16H15NO2S
Molecular weight
285.37
Exact mass
285.0823
XLogP
3.91
TPSA
38.66
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
20
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
80.27

Supplementary Information

InChIKey: GLZDHRHJOMVXAP-UHFFFAOYSA-N
Synonyme
SCHEMBL1841743GLZDHRHJOMVXAP-UHFFFAOYSA-NDB-1346852-(2-Benzothienyl)-3-oxa-1-azaspiro[4.5]dec-1-en-4-one2-Benzo[b]thien-2-yl-3-oxa-1-azaspiro[4.5]dec-1-en-4-one944282-06-8
Quelle anzeigen →
An 20 Reaktionen beteiligt→

Erweiterte Suche

Teilstruktursuche→Ähnlichkeitssuche→