AI59251
885312-80-1 | Ethyl 3-amino-4-(cyclopentylamino)benzoate
Manufacturer: A2B Chem
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CatalogNumber
AI59251
ChemicalName
Ethyl 3-amino-4-(cyclopentylamino)benzoate
CasNumber
885312-80-1
MolecularFormula
C14H20N2O2
MolecularWeight
248.3208
MdlNumber
MFCD13343642
Smiles
CCOC(=O)c1ccc(c(c1)N)NC1CCCC1
Complexity
277
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
5
Xlogp3
2.7
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CatalogNumber: AI59251
ChemicalName: Ethyl 3-amino-4-(cyclopentylamino)benzoate
CasNumber: 885312-80-1
MolecularFormula: C14H20N2O2
MolecularWeight: 248.3208
MdlNumber: MFCD13343642
Smiles: CCOC(=O)c1ccc(c(c1)N)NC1CCCC1
Complexity: 277
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 5
Xlogp3: 2.7
CatalogNumber:
AI59251
ChemicalName:
Ethyl 3-amino-4-(cyclopentylamino)benzoate
CasNumber:
885312-80-1
MolecularFormula:
C14H20N2O2
MolecularWeight:
248.3208
MdlNumber:
MFCD13343642
Smiles:
CCOC(=O)c1ccc(c(c1)N)NC1CCCC1
Complexity:
277
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
5
Xlogp3:
2.7
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Smiles: COCCNN.Cl.Cl
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HydrogenBondAcceptorCount: __
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RotatableBondCount: __
Xlogp3: __
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Smiles:
COCCNN.Cl.Cl
Complexity:
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RotatableBondCount:
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Smiles: c1cc2c(s1)c1c([nH]2)ccs1
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Smiles:
c1cc2c(s1)c1c([nH]2)ccs1
Complexity:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: CCS(=O)(=O)n1cccc1
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Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CCS(=O)(=O)n1cccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__