$CC(=O)N/N=C1\Nc2sc(C)c(C)c2C(c2ccc(Cl)cc2)=NC1(C)C$

Name: (Z)—N′-(5-(4-chlorophenyl)-3,3,6,7-tetramethyl-1H-thieno[2,3-e][1,4]diazepin-2(3H)-ylidene)acetohydrazide

SMILES: CC(=O)N/N=C1\Nc2sc(C)c(C)c2C(c2ccc(Cl)cc2)=NC1(C)C

Molecular Processing

Molecular formula

C19H21ClN4OS

Molecular weight

388.92

Exact mass

388.1125

XLogP

4.51

TPSA

65.85

H-bond donors

H-bond acceptors

Rotatable bonds

Heavy atoms

Rings

Aromatic rings

Saturated rings

Aliphatic rings

Stereo centers

Undefined stereo

Formal charge

Heteroatoms

Covalent units

Fraction Csp3

0.316

Molar refractivity

109.84

Supplementary Information

Details werden geladen…