AE62683
1393441-60-5 | Z-DL-Phg-NHMe
Manufacturer: A2B Chem
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CatalogNumber
AE62683
ChemicalName
Z-DL-Phg-NHMe
CasNumber
1393441-60-5
MolecularFormula
C17H18N2O3
MolecularWeight
298.3364
MdlNumber
MFCD22383727
Smiles
CNC(=O)C(c1ccccc1)NC(=O)OCc1ccccc1
Complexity
361
Covalently-bondedUnitCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
6
UndefinedAtomStereocenterCount
1
Xlogp3
2.5
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CatalogNumber: AE62683
ChemicalName: Z-DL-Phg-NHMe
CasNumber: 1393441-60-5
MolecularFormula: C17H18N2O3
MolecularWeight: 298.3364
MdlNumber: MFCD22383727
Smiles: CNC(=O)C(c1ccccc1)NC(=O)OCc1ccccc1
Complexity: 361
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 6
UndefinedAtomStereocenterCount: 1
Xlogp3: 2.5
CatalogNumber:
AE62683
ChemicalName:
Z-DL-Phg-NHMe
CasNumber:
1393441-60-5
MolecularFormula:
C17H18N2O3
MolecularWeight:
298.3364
MdlNumber:
MFCD22383727
Smiles:
CNC(=O)C(c1ccccc1)NC(=O)OCc1ccccc1
Complexity:
361
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
6
UndefinedAtomStereocenterCount:
1
Xlogp3:
2.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCNC(=O)C(c1ccccc1)NC(=O)OCc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCNC(=O)C(c1ccccc1)NC(=O)OCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCn1cnc2c1ccc(c2)C#N
Complexity: 242
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 2
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCn1cnc2c1ccc(c2)C#N
Complexity:
242
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
2
CatalogNumber: AE62686
ChemicalName: 1-Propyl-1,2,3-benzotriazole-5-carbonitrile
CasNumber: 1400644-57-6
MolecularFormula: C10H10N4
MolecularWeight: 186.2132
MdlNumber: MFCD22421517
Smiles: CCCn1nnc2c1ccc(c2)C#N
Complexity: 244
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 2
UndefinedAtomStereocenterCount: __
Xlogp3: 1.8
CatalogNumber:
AE62686
ChemicalName:
1-Propyl-1,2,3-benzotriazole-5-carbonitrile
CasNumber:
1400644-57-6
MolecularFormula:
C10H10N4
MolecularWeight:
186.2132
MdlNumber:
MFCD22421517
Smiles:
CCCn1nnc2c1ccc(c2)C#N
Complexity:
244
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
__
Xlogp3:
1.8