AG21769
503859-27-6 | Methyl 3-amino-4-(cyclohexylamino)benzoate
Manufacturer: A2B Chem
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CatalogNumber
AG21769
ChemicalName
Methyl 3-amino-4-(cyclohexylamino)benzoate
CasNumber
503859-27-6
MolecularFormula
C14H20N2O2
MolecularWeight
248.3208
MdlNumber
MFCD13343558
Smiles
COC(=O)c1ccc(c(c1)N)NC1CCCCC1
Complexity
277
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
4
Xlogp3
2.9
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CatalogNumber: AG21769
ChemicalName: Methyl 3-amino-4-(cyclohexylamino)benzoate
CasNumber: 503859-27-6
MolecularFormula: C14H20N2O2
MolecularWeight: 248.3208
MdlNumber: MFCD13343558
Smiles: COC(=O)c1ccc(c(c1)N)NC1CCCCC1
Complexity: 277
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 4
Xlogp3: 2.9
CatalogNumber:
AG21769
ChemicalName:
Methyl 3-amino-4-(cyclohexylamino)benzoate
CasNumber:
503859-27-6
MolecularFormula:
C14H20N2O2
MolecularWeight:
248.3208
MdlNumber:
MFCD13343558
Smiles:
COC(=O)c1ccc(c(c1)N)NC1CCCCC1
Complexity:
277
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
4
Xlogp3:
2.9
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Smiles: CC(=O)C(C(=O)C)NC(=O)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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Smiles:
CC(=O)C(C(=O)C)NC(=O)C
Complexity:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: CC(=C)C(=O)NC1=CC(=C(C=C1)C(=O)O)O
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HeavyAtomCount: __
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Smiles:
CC(=C)C(=O)NC1=CC(=C(C=C1)C(=O)O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
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MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCNS(=O)(=O)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCNS(=O)(=O)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__