AE62147
1248102-78-4 | 2-Butanoyl-3-picoline
Manufacturer: A2B Chem
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CatalogNumber
AE62147
ChemicalName
2-Butanoyl-3-picoline
CasNumber
1248102-78-4
MolecularFormula
C10H13NO
MolecularWeight
163.2163
MdlNumber
MFCD16087793
Smiles
CCCC(=O)c1ncccc1C
Complexity
156
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
2
RotatableBondCount
3
Xlogp3
2.1
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CatalogNumber: AE62147
ChemicalName: 2-Butanoyl-3-picoline
CasNumber: 1248102-78-4
MolecularFormula: C10H13NO
MolecularWeight: 163.2163
MdlNumber: MFCD16087793
Smiles: CCCC(=O)c1ncccc1C
Complexity: 156
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
RotatableBondCount: 3
Xlogp3: 2.1
CatalogNumber:
AE62147
ChemicalName:
2-Butanoyl-3-picoline
CasNumber:
1248102-78-4
MolecularFormula:
C10H13NO
MolecularWeight:
163.2163
MdlNumber:
MFCD16087793
Smiles:
CCCC(=O)c1ncccc1C
Complexity:
156
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
RotatableBondCount:
3
Xlogp3:
2.1
CatalogNumber: AE62148
ChemicalName: 4-Bromo-2,5-difluoropyridine
CasNumber: 1349718-16-6
MolecularFormula: C5H2BrF2N
MolecularWeight: 193.9769
MdlNumber: MFCD19686165
Smiles: Fc1ncc(c(c1)Br)F
Complexity: 101
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 3
RotatableBondCount: __
Xlogp3: 2.1
CatalogNumber:
AE62148
ChemicalName:
4-Bromo-2,5-difluoropyridine
CasNumber:
1349718-16-6
MolecularFormula:
C5H2BrF2N
MolecularWeight:
193.9769
MdlNumber:
MFCD19686165
Smiles:
Fc1ncc(c(c1)Br)F
Complexity:
101
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
3
RotatableBondCount:
__
Xlogp3:
2.1
CatalogNumber: AE62149
ChemicalName: N-(4-Pyrrolidinobenzyl) 4-pyrrolidinobenzamide
CasNumber: 1423037-21-1
MolecularFormula: C22H27N3O
MolecularWeight: 349.4693
MdlNumber: MFCD23135935
Smiles: O=C(c1ccc(cc1)N1CCCC1)NCc1ccc(cc1)N1CCCC1
Complexity: 440
Covalently-bondedUnitCount: 1
HeavyAtomCount: 26
HydrogenBondAcceptorCount: 3
RotatableBondCount: 5
Xlogp3: 3.4
CatalogNumber:
AE62149
ChemicalName:
N-(4-Pyrrolidinobenzyl) 4-pyrrolidinobenzamide
CasNumber:
1423037-21-1
MolecularFormula:
C22H27N3O
MolecularWeight:
349.4693
MdlNumber:
MFCD23135935
Smiles:
O=C(c1ccc(cc1)N1CCCC1)NCc1ccc(cc1)N1CCCC1
Complexity:
440
Covalently-bondedUnitCount:
1
HeavyAtomCount:
26
HydrogenBondAcceptorCount:
3
RotatableBondCount:
5
Xlogp3:
3.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1ncccc1c1ccc(cc1)OCc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1ncccc1c1ccc(cc1)OCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__