AV18300
1932063-48-3 | Benzyl ((1r,3s)-3-aminocyclohexyl)carbamate
Manufacturer: A2B Chem
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CatalogNumber
AV18300
ChemicalName
Benzyl ((1r,3s)-3-aminocyclohexyl)carbamate
CasNumber
1932063-48-3
MolecularFormula
C14H20N2O2
MolecularWeight
248.3208
MdlNumber
MFCD18207256
Smiles
C1CC(CC(C1)NC(=O)OCC2=CC=CC=C2)N
Complexity
265
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
2
HeavyAtomCount
18
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
4
Xlogp3
1.8
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CatalogNumber: AV18300
ChemicalName: Benzyl ((1r,3s)-3-aminocyclohexyl)carbamate
CasNumber: 1932063-48-3
MolecularFormula: C14H20N2O2
MolecularWeight: 248.3208
MdlNumber: MFCD18207256
Smiles: C1CC(CC(C1)NC(=O)OCC2=CC=CC=C2)N
Complexity: 265
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 2
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 4
Xlogp3: 1.8
CatalogNumber:
AV18300
ChemicalName:
Benzyl ((1r,3s)-3-aminocyclohexyl)carbamate
CasNumber:
1932063-48-3
MolecularFormula:
C14H20N2O2
MolecularWeight:
248.3208
MdlNumber:
MFCD18207256
Smiles:
C1CC(CC(C1)NC(=O)OCC2=CC=CC=C2)N
Complexity:
265
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
2
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
4
Xlogp3:
1.8
CatalogNumber: AV18302
ChemicalName: (3,5-bis(ethoxycarbonyl)phenyl)boronic acid
CasNumber: 932378-94-4
MolecularFormula: C12H15BO6
MolecularWeight: 266.0549
MdlNumber: MFCD11867795
Smiles: CCOC(=O)c1cc(cc(c1)C(=O)OCC)B(O)O
Complexity: 293
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 7
Xlogp3: __
CatalogNumber:
AV18302
ChemicalName:
(3,5-bis(ethoxycarbonyl)phenyl)boronic acid
CasNumber:
932378-94-4
MolecularFormula:
C12H15BO6
MolecularWeight:
266.0549
MdlNumber:
MFCD11867795
Smiles:
CCOC(=O)c1cc(cc(c1)C(=O)OCC)B(O)O
Complexity:
293
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
7
Xlogp3:
__
CatalogNumber: AV18303
ChemicalName: (1R,4R,5S)-tert-Butyl 5-hydroxy-2-azabicyclo[2.2.1]heptane-2-carboxylate
CasNumber: 207405-69-4
MolecularFormula: C11H19NO3
MolecularWeight: 213.2735
MdlNumber: MFCD17016678
Smiles: O[C@H]1C[C@@H]2C[C@H]1CN2C(=O)OC(C)(C)C
Complexity: 272
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 3
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.1
CatalogNumber:
AV18303
ChemicalName:
(1R,4R,5S)-tert-Butyl 5-hydroxy-2-azabicyclo[2.2.1]heptane-2-carboxylate
CasNumber:
207405-69-4
MolecularFormula:
C11H19NO3
MolecularWeight:
213.2735
MdlNumber:
MFCD17016678
Smiles:
O[C@H]1C[C@@H]2C[C@H]1CN2C(=O)OC(C)(C)C
Complexity:
272
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
3
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(N1CC(C(C1)(C)C(=O)O)O)OC(C)(C)C
Complexity: 335
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 0.7
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(N1CC(C(C1)(C)C(=O)O)O)OC(C)(C)C
Complexity:
335
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
0.7