AI45216
220648-78-2 | tert-Butyl 4-(n-hydroxycarbamimidoyl)-benzylcarbamate
Manufacturer: A2B Chem
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CatalogNumber
AI45216
ChemicalName
tert-Butyl 4-(n-hydroxycarbamimidoyl)-benzylcarbamate
CasNumber
220648-78-2
MolecularFormula
C13H19N3O3
MolecularWeight
265.3083
MdlNumber
MFCD08703158
Smiles
ONC(=N)c1ccc(cc1)CNC(=O)OC(C)(C)C
Complexity
329
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
3
RotatableBondCount
5
UndefinedBondStereocenterCount
1
Xlogp3
1.6
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CatalogNumber: AI45216
ChemicalName: tert-Butyl 4-(n-hydroxycarbamimidoyl)-benzylcarbamate
CasNumber: 220648-78-2
MolecularFormula: C13H19N3O3
MolecularWeight: 265.3083
MdlNumber: MFCD08703158
Smiles: ONC(=N)c1ccc(cc1)CNC(=O)OC(C)(C)C
Complexity: 329
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 5
UndefinedBondStereocenterCount: 1
Xlogp3: 1.6
CatalogNumber:
AI45216
ChemicalName:
tert-Butyl 4-(n-hydroxycarbamimidoyl)-benzylcarbamate
CasNumber:
220648-78-2
MolecularFormula:
C13H19N3O3
MolecularWeight:
265.3083
MdlNumber:
MFCD08703158
Smiles:
ONC(=N)c1ccc(cc1)CNC(=O)OC(C)(C)C
Complexity:
329
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
5
UndefinedBondStereocenterCount:
1
Xlogp3:
1.6
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Smiles: CCOC(=O)c1cc2c([nH]1)c(Cl)c(cc2)Cl
Complexity: __
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Smiles:
CCOC(=O)c1cc2c([nH]1)c(Cl)c(cc2)Cl
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Smiles: Clc1cccc2c1nsn2
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Smiles:
Clc1cccc2c1nsn2
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Smiles: Oc1ccc2c(c1)oc(=O)c(c2)c1ccc(cc1)[N+](=O)[O-]
Complexity: __
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MolecularFormula:
__
MolecularWeight:
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MdlNumber:
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Smiles:
Oc1ccc2c(c1)oc(=O)c(c2)c1ccc(cc1)[N+](=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedBondStereocenterCount:
__
Xlogp3:
__