AE61945
1352318-65-0 | tert-Butyl N-[4-(3-cyanopyridin-2-yl)phenyl]carbamate
Manufacturer: A2B Chem
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CatalogNumber
AE61945
ChemicalName
tert-Butyl N-[4-(3-cyanopyridin-2-yl)phenyl]carbamate
CasNumber
1352318-65-0
MolecularFormula
C17H17N3O2
MolecularWeight
295.3358
MdlNumber
MFCD20529532
Smiles
N#Cc1cccnc1c1ccc(cc1)NC(=O)OC(C)(C)C
Complexity
427
Covalently-bondedUnitCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
2.8
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CatalogNumber: AE61945
ChemicalName: tert-Butyl N-[4-(3-cyanopyridin-2-yl)phenyl]carbamate
CasNumber: 1352318-65-0
MolecularFormula: C17H17N3O2
MolecularWeight: 295.3358
MdlNumber: MFCD20529532
Smiles: N#Cc1cccnc1c1ccc(cc1)NC(=O)OC(C)(C)C
Complexity: 427
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 2.8
CatalogNumber:
AE61945
ChemicalName:
tert-Butyl N-[4-(3-cyanopyridin-2-yl)phenyl]carbamate
CasNumber:
1352318-65-0
MolecularFormula:
C17H17N3O2
MolecularWeight:
295.3358
MdlNumber:
MFCD20529532
Smiles:
N#Cc1cccnc1c1ccc(cc1)NC(=O)OC(C)(C)C
Complexity:
427
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
2.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)/C=C/c1cc(ccc1Br)C(F)(F)F
Complexity: 315
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 4.1
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)/C=C/c1cc(ccc1Br)C(F)(F)F
Complexity:
315
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
4.1
CatalogNumber: AE61947
ChemicalName: 5-Fluoro-2-methoxy-3-nitropyridine
CasNumber: 1211534-27-8
MolecularFormula: C6H5FN2O3
MolecularWeight: 172.1139
MdlNumber: MFCD18260977
Smiles: [O-][N+](=O)c1cc(F)cnc1OC
Complexity: 173
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 1.1
CatalogNumber:
AE61947
ChemicalName:
5-Fluoro-2-methoxy-3-nitropyridine
CasNumber:
1211534-27-8
MolecularFormula:
C6H5FN2O3
MolecularWeight:
172.1139
MdlNumber:
MFCD18260977
Smiles:
[O-][N+](=O)c1cc(F)cnc1OC
Complexity:
173
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
1.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1cccc(c1)c1cccc(c1)OCc1ccccc1
Complexity: 300
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 5.1
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1cccc(c1)c1cccc(c1)OCc1ccccc1
Complexity:
300
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
5.1