AV18652
1702300-72-8 | tert-Butyl 4-(3-chloropropyl)-4-cyanopiperidine-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AV18652
ChemicalName
tert-Butyl 4-(3-chloropropyl)-4-cyanopiperidine-1-carboxylate
CasNumber
1702300-72-8
MolecularFormula
C14H23ClN2O2
MolecularWeight
286.7976
MdlNumber
MFCD22384468
Smiles
ClCCCC1(C#N)CCN(CC1)C(=O)OC(C)(C)C
Complexity
359
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
3
RotatableBondCount
5
Xlogp3
2.5
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CatalogNumber: AV18652
ChemicalName: tert-Butyl 4-(3-chloropropyl)-4-cyanopiperidine-1-carboxylate
CasNumber: 1702300-72-8
MolecularFormula: C14H23ClN2O2
MolecularWeight: 286.7976
MdlNumber: MFCD22384468
Smiles: ClCCCC1(C#N)CCN(CC1)C(=O)OC(C)(C)C
Complexity: 359
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 3
RotatableBondCount: 5
Xlogp3: 2.5
CatalogNumber:
AV18652
ChemicalName:
tert-Butyl 4-(3-chloropropyl)-4-cyanopiperidine-1-carboxylate
CasNumber:
1702300-72-8
MolecularFormula:
C14H23ClN2O2
MolecularWeight:
286.7976
MdlNumber:
MFCD22384468
Smiles:
ClCCCC1(C#N)CCN(CC1)C(=O)OC(C)(C)C
Complexity:
359
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
3
RotatableBondCount:
5
Xlogp3:
2.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Brc1ccc(cc1)S(=O)(=O)Nc1ccc(c(c1)F)Br
Complexity: 393
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 3.9
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Brc1ccc(cc1)S(=O)(=O)Nc1ccc(c(c1)F)Br
Complexity:
393
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
3.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N#Cc1cnc2c(c1)cc(cc2F)F
Complexity: 260
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.1
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N#Cc1cnc2c(c1)cc(cc2F)F
Complexity:
260
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(CNCC(O)(C)C)(O)C
Complexity: 107
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: -0.3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(CNCC(O)(C)C)(O)C
Complexity:
107
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
-0.3