AI48437
344763-79-7 | 2-(2,5-Dimethoxyphenyl)-1h-indole
Manufacturer: A2B Chem
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CatalogNumber
AI48437
ChemicalName
2-(2,5-Dimethoxyphenyl)-1h-indole
CasNumber
344763-79-7
MolecularFormula
C16H15NO2
MolecularWeight
253.2958
MdlNumber
MFCD04966831
Smiles
COc1ccc(c(c1)c1cc2c([nH]1)cccc2)OC
Complexity
297
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
3.7
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CatalogNumber: AI48437
ChemicalName: 2-(2,5-Dimethoxyphenyl)-1h-indole
CasNumber: 344763-79-7
MolecularFormula: C16H15NO2
MolecularWeight: 253.2958
MdlNumber: MFCD04966831
Smiles: COc1ccc(c(c1)c1cc2c([nH]1)cccc2)OC
Complexity: 297
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 3.7
CatalogNumber:
AI48437
ChemicalName:
2-(2,5-Dimethoxyphenyl)-1h-indole
CasNumber:
344763-79-7
MolecularFormula:
C16H15NO2
MolecularWeight:
253.2958
MdlNumber:
MFCD04966831
Smiles:
COc1ccc(c(c1)c1cc2c([nH]1)cccc2)OC
Complexity:
297
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
3.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCC[C@@H](c1ccc(cc1)C)N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCC[C@@H](c1ccc(cc1)C)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AI48439
ChemicalName: 6-Trifluoromethylpyridin-2-one
CasNumber: 34486-06-1
MolecularFormula: C6H4F3NO
MolecularWeight: 163.0973
MdlNumber: MFCD08061317
Smiles: Oc1cccc(n1)C(F)(F)F
Complexity: 239
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: __
Xlogp3: 1.1
CatalogNumber:
AI48439
ChemicalName:
6-Trifluoromethylpyridin-2-one
CasNumber:
34486-06-1
MolecularFormula:
C6H4F3NO
MolecularWeight:
163.0973
MdlNumber:
MFCD08061317
Smiles:
Oc1cccc(n1)C(F)(F)F
Complexity:
239
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
__
Xlogp3:
1.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-]c1ccc(cc1)C1(OS(=O)(=O)c2c1cccc2)c1ccc(cc1)O.[Na+]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-]c1ccc(cc1)C1(OS(=O)(=O)c2c1cccc2)c1ccc(cc1)O.[Na+]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__