AE99654
19313-87-2 | 3-Chloro-n-(4-methoxyphenyl)propanamide
Manufacturer: A2B Chem
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CatalogNumber
AE99654
ChemicalName
3-Chloro-n-(4-methoxyphenyl)propanamide
CasNumber
19313-87-2
MolecularFormula
C10H12ClNO2
MolecularWeight
213.6608
MdlNumber
MFCD01357906
Smiles
ClCCC(=O)Nc1ccc(cc1)OC
Complexity
179
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
1.6
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CatalogNumber: AE99654
ChemicalName: 3-Chloro-n-(4-methoxyphenyl)propanamide
CasNumber: 19313-87-2
MolecularFormula: C10H12ClNO2
MolecularWeight: 213.6608
MdlNumber: MFCD01357906
Smiles: ClCCC(=O)Nc1ccc(cc1)OC
Complexity: 179
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 1.6
CatalogNumber:
AE99654
ChemicalName:
3-Chloro-n-(4-methoxyphenyl)propanamide
CasNumber:
19313-87-2
MolecularFormula:
C10H12ClNO2
MolecularWeight:
213.6608
MdlNumber:
MFCD01357906
Smiles:
ClCCC(=O)Nc1ccc(cc1)OC
Complexity:
179
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
1.6
CatalogNumber: AE99655
ChemicalName: Ethyl 3-cyano-1,2-dihydro-6-methyl-2-oxopyridine-4-carboxylate
CasNumber: 18619-97-1
MolecularFormula: C10H10N2O3
MolecularWeight: 206.198
MdlNumber: MFCD00052274
Smiles: CCOC(=O)c1cc(C)nc(c1C#N)O
Complexity: 423
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 0.4
CatalogNumber:
AE99655
ChemicalName:
Ethyl 3-cyano-1,2-dihydro-6-methyl-2-oxopyridine-4-carboxylate
CasNumber:
18619-97-1
MolecularFormula:
C10H10N2O3
MolecularWeight:
206.198
MdlNumber:
MFCD00052274
Smiles:
CCOC(=O)c1cc(C)nc(c1C#N)O
Complexity:
423
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
0.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC[C@@H](C(=O)OC)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC[C@@H](C(=O)OC)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(N/C(=C/c1ccccc1)/C(=O)O)OCC1c2ccccc2-c2c1cccc2
Complexity: 602
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 4.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(N/C(=C/c1ccccc1)/C(=O)O)OCC1c2ccccc2-c2c1cccc2
Complexity:
602
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
4.8