AI62821
94-45-1 | 2-Amino-6-ethoxybenzothiazole
Manufacturer: A2B Chem
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CatalogNumber
AI62821
ChemicalName
2-Amino-6-ethoxybenzothiazole
CasNumber
94-45-1
MolecularFormula
C9H10N2OS
MolecularWeight
194.2535
MdlNumber
MFCD00005788
Smiles
CCOc1ccc2c(c1)sc(n2)N
NscNumber
28731
Complexity
179
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.8
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CatalogNumber: AI62821
ChemicalName: 2-Amino-6-ethoxybenzothiazole
CasNumber: 94-45-1
MolecularFormula: C9H10N2OS
MolecularWeight: 194.2535
MdlNumber: MFCD00005788
Smiles: CCOc1ccc2c(c1)sc(n2)N
NscNumber: 28731
Complexity: 179
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.8
CatalogNumber:
AI62821
ChemicalName:
2-Amino-6-ethoxybenzothiazole
CasNumber:
94-45-1
MolecularFormula:
C9H10N2OS
MolecularWeight:
194.2535
MdlNumber:
MFCD00005788
Smiles:
CCOc1ccc2c(c1)sc(n2)N
NscNumber:
28731
Complexity:
179
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(c1ccccc1)OCCc1ccccc1
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(c1ccccc1)OCCc1ccccc1
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AI62823
ChemicalName: 2-(2-Aminophenylthio)acetic acid
CasNumber: 94-56-4
MolecularFormula: C8H9NO2S
MolecularWeight: 183.2276
MdlNumber: MFCD06740828
Smiles: OC(=O)CSc1ccccc1N
NscNumber: __
Complexity: 163
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: 1.3
CatalogNumber:
AI62823
ChemicalName:
2-(2-Aminophenylthio)acetic acid
CasNumber:
94-56-4
MolecularFormula:
C8H9NO2S
MolecularWeight:
183.2276
MdlNumber:
MFCD06740828
Smiles:
OC(=O)CSc1ccccc1N
NscNumber:
__
Complexity:
163
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
1.3
CatalogNumber: AI62824
ChemicalName: (2E,4E)-5-(2H-1,3-benzodioxol-5-yl)-1-(piperidin-1-yl)penta-2,4-dien-1-one
CasNumber: 94-62-2
MolecularFormula: C17H19NO3
MolecularWeight: 285.33765999999997
MdlNumber: MFCD00005839
Smiles: O=C(N1CCCCC1)/C=C/C=C/c1ccc2c(c1)OCO2
NscNumber: __
Complexity: 412
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 3
Xlogp3: 3.5
CatalogNumber:
AI62824
ChemicalName:
(2E,4E)-5-(2H-1,3-benzodioxol-5-yl)-1-(piperidin-1-yl)penta-2,4-dien-1-one
CasNumber:
94-62-2
MolecularFormula:
C17H19NO3
MolecularWeight:
285.33765999999997
MdlNumber:
MFCD00005839
Smiles:
O=C(N1CCCCC1)/C=C/C=C/c1ccc2c(c1)OCO2
NscNumber:
__
Complexity:
412
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
3
Xlogp3:
3.5