AG68122
64230-41-7 | 1-Methylpyrrole-2-carboxamide
Manufacturer: A2B Chem
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CatalogNumber
AG68122
ChemicalName
1-Methylpyrrole-2-carboxamide
CasNumber
64230-41-7
MolecularFormula
C6H8N2O
MolecularWeight
124.1405
MdlNumber
MFCD03654144
Smiles
NC(=O)c1cccn1C
Complexity
124
Covalently-bondedUnitCount
1
HeavyAtomCount
9
HydrogenBondAcceptorCount
1
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
-0.1
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CatalogNumber: AG68122
ChemicalName: 1-Methylpyrrole-2-carboxamide
CasNumber: 64230-41-7
MolecularFormula: C6H8N2O
MolecularWeight: 124.1405
MdlNumber: MFCD03654144
Smiles: NC(=O)c1cccn1C
Complexity: 124
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: -0.1
CatalogNumber:
AG68122
ChemicalName:
1-Methylpyrrole-2-carboxamide
CasNumber:
64230-41-7
MolecularFormula:
C6H8N2O
MolecularWeight:
124.1405
MdlNumber:
MFCD03654144
Smiles:
NC(=O)c1cccn1C
Complexity:
124
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
-0.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCc1onc(n1)c1ccc(cc1)Cl
Complexity: 195
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCc1onc(n1)c1ccc(cc1)Cl
Complexity:
195
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1nn(c(c1Br)Br)C
Complexity: 109
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1nn(c(c1Br)Br)C
Complexity:
109
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.3
CatalogNumber: AG68125
ChemicalName: 4-Chloro-3-propoxybenzoic acid
CasNumber: 65136-52-9
MolecularFormula: C10H11ClO3
MolecularWeight: 214.6455
MdlNumber: MFCD18434435
Smiles: CCCOc1cc(ccc1Cl)C(=O)O
Complexity: 196
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 2.8
CatalogNumber:
AG68125
ChemicalName:
4-Chloro-3-propoxybenzoic acid
CasNumber:
65136-52-9
MolecularFormula:
C10H11ClO3
MolecularWeight:
214.6455
MdlNumber:
MFCD18434435
Smiles:
CCCOc1cc(ccc1Cl)C(=O)O
Complexity:
196
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
2.8