AI36583
1488675-62-2 | 3-Amino-1-(1-benzothiophen-5-yl)urea
Manufacturer: A2B Chem
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CatalogNumber
AI36583
ChemicalName
3-Amino-1-(1-benzothiophen-5-yl)urea
CasNumber
1488675-62-2
MolecularFormula
C9H9N3OS
MolecularWeight
207.2523
MdlNumber
MFCD21236779
Smiles
NNC(=O)Nc1ccc2c(c1)ccs2
Complexity
224
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
3
RotatableBondCount
1
Xlogp3
1.3
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CatalogNumber: AI36583
ChemicalName: 3-Amino-1-(1-benzothiophen-5-yl)urea
CasNumber: 1488675-62-2
MolecularFormula: C9H9N3OS
MolecularWeight: 207.2523
MdlNumber: MFCD21236779
Smiles: NNC(=O)Nc1ccc2c(c1)ccs2
Complexity: 224
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 3
RotatableBondCount: 1
Xlogp3: 1.3
CatalogNumber:
AI36583
ChemicalName:
3-Amino-1-(1-benzothiophen-5-yl)urea
CasNumber:
1488675-62-2
MolecularFormula:
C9H9N3OS
MolecularWeight:
207.2523
MdlNumber:
MFCD21236779
Smiles:
NNC(=O)Nc1ccc2c(c1)ccs2
Complexity:
224
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
3
RotatableBondCount:
1
Xlogp3:
1.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOc1ccc(cc1)NC(=O)c1ccccn1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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Smiles:
CCOc1ccc(cc1)NC(=O)c1ccccn1
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: COc1ccc(c2c1nccc2)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
COc1ccc(c2c1nccc2)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][N+](=O)c1ccc2c(c1)OC1(O2)CCCC1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-][N+](=O)c1ccc2c(c1)OC1(O2)CCCC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__