C1CCN(C1)CCSC2=CC(=CC=C2)Br
CAS: 867330-88-9
الاسم: 1-[2-(3-bromophenyl)sulfanylethyl]pyrrolidine
SMILES: C1CCN(C1)CCSC2=CC(=CC=C2)Br

Molecular Processing

Molecular formula
C12H16BrNS
Molecular weight
286.24
Exact mass
285.0187
XLogP
3.64
TPSA
3.24
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
70.54

Supplementary Information

InChIKey: CMSUZWBXZJEKLH-UHFFFAOYSA-N
مرادفات
1-[2-(3-bromo-phenylsulfanyl)-ethyl]-pyrrolidine867330-88-9SCHEMBL4276092CMSUZWBXZJEKLH-UHFFFAOYSA-NDB-363146
عرض المصدر →
مشارك في 6 تفاعل→

بحث موسع

بحث البنية الفرعية→بحث التشابه→