الاسم: 1-ethyl-3-(6-nitro-1,3-benzothiazol-2-yl)urea
SMILES:
CCNC(=O)NC1=NC2=C(S1)C=C(C=C2)[N+](=O)[O-]Molecular Processing
Molecular formula
C10H10N4O3S
Molecular weight
266.28
Exact mass
266.0474
XLogP
2.35
TPSA
97.16
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
68.97
Supplementary Information
InChIKey: PVPCQTDQDYMZRD-UHFFFAOYSA-N
مرادفات
SCHEMBL6068032PVPCQTDQDYMZRD-UHFFFAOYSA-NN-Ethyl-N'-(6-nitro-1,3-benzothiazol-2-yl)urea
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