AI38594
167954-49-6 | (1H-Indol-2-yl)-carbamic acid tert-butyl ester
Manufacturer: A2B Chem
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CatalogNumber
AI38594
ChemicalName
(1H-Indol-2-yl)-carbamic acid tert-butyl ester
CasNumber
167954-49-6
MolecularFormula
C13H16N2O2
MolecularWeight
232.2783
MdlNumber
MFCD16629876
Smiles
O=C(OC(C)(C)C)Nc1cc2c([nH]1)cccc2
Complexity
286
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
2
RotatableBondCount
3
Xlogp3
2.9
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CatalogNumber: AI38594
ChemicalName: (1H-Indol-2-yl)-carbamic acid tert-butyl ester
CasNumber: 167954-49-6
MolecularFormula: C13H16N2O2
MolecularWeight: 232.2783
MdlNumber: MFCD16629876
Smiles: O=C(OC(C)(C)C)Nc1cc2c([nH]1)cccc2
Complexity: 286
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: 2.9
CatalogNumber:
AI38594
ChemicalName:
(1H-Indol-2-yl)-carbamic acid tert-butyl ester
CasNumber:
167954-49-6
MolecularFormula:
C13H16N2O2
MolecularWeight:
232.2783
MdlNumber:
MFCD16629876
Smiles:
O=C(OC(C)(C)C)Nc1cc2c([nH]1)cccc2
Complexity:
286
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
2.9
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Smiles: Nc1ccc(cc1)S(=O)(=O)Nc1cccc(c1)C
Complexity: __
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Smiles:
Nc1ccc(cc1)S(=O)(=O)Nc1cccc(c1)C
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Smiles: C[C@H]1C[C@H](CN(C1)C(=O)OCc1ccccc1)C(=O)O
Complexity: __
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Smiles:
C[C@H]1C[C@H](CN(C1)C(=O)OCc1ccccc1)C(=O)O
Complexity:
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HeavyAtomCount:
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RotatableBondCount:
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Smiles: C=CCC(C(=O)C(=O)O)(F)F
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
C=CCC(C(=O)C(=O)O)(F)F
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
__