AH21608
71888-24-9 | 4-(Diethylcarbamoyl)benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AH21608
ChemicalName
4-(Diethylcarbamoyl)benzoic acid
CasNumber
71888-24-9
MolecularFormula
C12H15NO3
MolecularWeight
221.2524
MdlNumber
MFCD12173474
Smiles
CCN(C(=O)c1ccc(cc1)C(=O)O)CC
Complexity
253
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
0.8
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CatalogNumber: AH21608
ChemicalName: 4-(Diethylcarbamoyl)benzoic acid
CasNumber: 71888-24-9
MolecularFormula: C12H15NO3
MolecularWeight: 221.2524
MdlNumber: MFCD12173474
Smiles: CCN(C(=O)c1ccc(cc1)C(=O)O)CC
Complexity: 253
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 0.8
CatalogNumber:
AH21608
ChemicalName:
4-(Diethylcarbamoyl)benzoic acid
CasNumber:
71888-24-9
MolecularFormula:
C12H15NO3
MolecularWeight:
221.2524
MdlNumber:
MFCD12173474
Smiles:
CCN(C(=O)c1ccc(cc1)C(=O)O)CC
Complexity:
253
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
0.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1CCCN1c1cccc(c1C)N
Complexity: 229
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1CCCN1c1cccc(c1C)N
Complexity:
229
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1
CatalogNumber: AH21610
ChemicalName: N-Butyl-2-chloropyrimidin-4-amine
CasNumber: 66229-56-9
MolecularFormula: C8H12ClN3
MolecularWeight: 185.654
MdlNumber: MFCD16712456
Smiles: CCCCNc1ccnc(n1)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AH21610
ChemicalName:
N-Butyl-2-chloropyrimidin-4-amine
CasNumber:
66229-56-9
MolecularFormula:
C8H12ClN3
MolecularWeight:
185.654
MdlNumber:
MFCD16712456
Smiles:
CCCCNc1ccnc(n1)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1cccc(c1)C(=O)NC(C)(C)C
Complexity: 294
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.6
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1cccc(c1)C(=O)NC(C)(C)C
Complexity:
294
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.6