AI40766
1820703-78-3 | Ethyl 3-amino-5-bromo-4-(ethylamino)benzoate
Manufacturer: A2B Chem
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CatalogNumber
AI40766
ChemicalName
Ethyl 3-amino-5-bromo-4-(ethylamino)benzoate
CasNumber
1820703-78-3
MolecularFormula
C11H15BrN2O2
MolecularWeight
287.153
MdlNumber
MFCD25953925
Smiles
CCOC(=O)c1cc(N)c(c(c1)Br)NCC
Complexity
238
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
5
Xlogp3
2.5
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CatalogNumber: AI40766
ChemicalName: Ethyl 3-amino-5-bromo-4-(ethylamino)benzoate
CasNumber: 1820703-78-3
MolecularFormula: C11H15BrN2O2
MolecularWeight: 287.153
MdlNumber: MFCD25953925
Smiles: CCOC(=O)c1cc(N)c(c(c1)Br)NCC
Complexity: 238
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 5
Xlogp3: 2.5
CatalogNumber:
AI40766
ChemicalName:
Ethyl 3-amino-5-bromo-4-(ethylamino)benzoate
CasNumber:
1820703-78-3
MolecularFormula:
C11H15BrN2O2
MolecularWeight:
287.153
MdlNumber:
MFCD25953925
Smiles:
CCOC(=O)c1cc(N)c(c(c1)Br)NCC
Complexity:
238
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
5
Xlogp3:
2.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(N1CCN(CC1)c1ccc(c(c1)Cl)Br)OC(C)(C)C
Complexity: 367
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 4
CatalogNumber:
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ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
O=C(N1CCN(CC1)c1ccc(c(c1)Cl)Br)OC(C)(C)C
Complexity:
367
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCCCOCCCn1cccn1
Complexity: 122
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCCCOCCCn1cccn1
Complexity:
122
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1nc2CNCCc2cn1.Cl.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1nc2CNCCc2cn1.Cl.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__