AD76155
1072944-47-8 | Methyl 5-cyclopropyl-1-(pyridin-2-yl)-1H-pyrazole-4-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AD76155
ChemicalName
Methyl 5-cyclopropyl-1-(pyridin-2-yl)-1H-pyrazole-4-carboxylate
CasNumber
1072944-47-8
MolecularFormula
C13H13N3O2
MolecularWeight
243.2612
MdlNumber
MFCD11504891
Smiles
COC(=O)c1cnn(c1C1CC1)c1ccccn1
Complexity
319
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
4
RotatableBondCount
4
Xlogp3
1.6
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CatalogNumber: AD76155
ChemicalName: Methyl 5-cyclopropyl-1-(pyridin-2-yl)-1H-pyrazole-4-carboxylate
CasNumber: 1072944-47-8
MolecularFormula: C13H13N3O2
MolecularWeight: 243.2612
MdlNumber: MFCD11504891
Smiles: COC(=O)c1cnn(c1C1CC1)c1ccccn1
Complexity: 319
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
Xlogp3: 1.6
CatalogNumber:
AD76155
ChemicalName:
Methyl 5-cyclopropyl-1-(pyridin-2-yl)-1H-pyrazole-4-carboxylate
CasNumber:
1072944-47-8
MolecularFormula:
C13H13N3O2
MolecularWeight:
243.2612
MdlNumber:
MFCD11504891
Smiles:
COC(=O)c1cnn(c1C1CC1)c1ccccn1
Complexity:
319
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
Xlogp3:
1.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCNC(=O)c1ccc(c(c1)OC)Br
Complexity: 199
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.2
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCNC(=O)c1ccc(c(c1)OC)Br
Complexity:
199
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.2
CatalogNumber: AD76158
ChemicalName: N-Propyl 4-bromo-3-methoxybenzamide
CasNumber: 1072944-38-7
MolecularFormula: C11H14BrNO2
MolecularWeight: 272.1384
MdlNumber: MFCD11504873
Smiles: CCCNC(=O)c1ccc(c(c1)OC)Br
Complexity: 211
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 2
RotatableBondCount: 4
Xlogp3: 2.8
CatalogNumber:
AD76158
ChemicalName:
N-Propyl 4-bromo-3-methoxybenzamide
CasNumber:
1072944-38-7
MolecularFormula:
C11H14BrNO2
MolecularWeight:
272.1384
MdlNumber:
MFCD11504873
Smiles:
CCCNC(=O)c1ccc(c(c1)OC)Br
Complexity:
211
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
2
RotatableBondCount:
4
Xlogp3:
2.8
CatalogNumber: AD76159
ChemicalName: N,N-Diisopropyl 4-bromo-3-methoxybenzamide
CasNumber: 1072944-37-6
MolecularFormula: C14H20BrNO2
MolecularWeight: 314.2181
MdlNumber: MFCD11504872
Smiles: COc1cc(ccc1Br)C(=O)N(C(C)C)C(C)C
Complexity: 273
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 2
RotatableBondCount: 4
Xlogp3: 3.6
CatalogNumber:
AD76159
ChemicalName:
N,N-Diisopropyl 4-bromo-3-methoxybenzamide
CasNumber:
1072944-37-6
MolecularFormula:
C14H20BrNO2
MolecularWeight:
314.2181
MdlNumber:
MFCD11504872
Smiles:
COc1cc(ccc1Br)C(=O)N(C(C)C)C(C)C
Complexity:
273
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
2
RotatableBondCount:
4
Xlogp3:
3.6