名称: Methyl 4-(3,4-dihydro-4-methyl-3-oxo-1,4[2H]-benzothiazin-7-yl)-4-oxo-3-methylbutyrate
SMILES:
COC(=O)CC(C)C(=O)c1ccc2c(c1)SCC(=O)N2CMolecular Processing
Molecular formula
C15H17NO4S
Molecular weight
307.37
Exact mass
307.0878
XLogP
2.14
TPSA
63.68
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
21
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
80.7
Supplementary Information
詳細情報を取得中…
4 件の反応に参加→