AV18232
449211-78-3 | (4-(2H-1,2,3-Triazol-2-yl)phenyl)methanol
Manufacturer: A2B Chem
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CatalogNumber
AV18232
ChemicalName
(4-(2H-1,2,3-Triazol-2-yl)phenyl)methanol
CasNumber
449211-78-3
MolecularFormula
C9H9N3O
MolecularWeight
175.1873
MdlNumber
MFCD30185865
Smiles
OCc1ccc(cc1)n1nccn1
Complexity
151
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1
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CatalogNumber: AV18232
ChemicalName: (4-(2H-1,2,3-Triazol-2-yl)phenyl)methanol
CasNumber: 449211-78-3
MolecularFormula: C9H9N3O
MolecularWeight: 175.1873
MdlNumber: MFCD30185865
Smiles: OCc1ccc(cc1)n1nccn1
Complexity: 151
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1
CatalogNumber:
AV18232
ChemicalName:
(4-(2H-1,2,3-Triazol-2-yl)phenyl)methanol
CasNumber:
449211-78-3
MolecularFormula:
C9H9N3O
MolecularWeight:
175.1873
MdlNumber:
MFCD30185865
Smiles:
OCc1ccc(cc1)n1nccn1
Complexity:
151
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1NN=C2C(C1)CCCc1c2cccc1
Complexity: 324
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1.9
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1NN=C2C(C1)CCCc1c2cccc1
Complexity:
324
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1ccc(cc1)/C=C(/C(=O)C(C)C)C(=O)Nc1ccccc1
Complexity: 444
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 4.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1ccc(cc1)/C=C(/C(=O)C(C)C)C(=O)Nc1ccccc1
Complexity:
444
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
4.8
CatalogNumber: AV18235
ChemicalName: 3-(Tetrahydro-2H-pyran-4-yl)indoline-5-carboxylic acid
CasNumber: 1160248-21-4
MolecularFormula: C14H17NO3
MolecularWeight: 247.2897
MdlNumber: MFCD12198794
Smiles: OC(=O)c1ccc2c(c1)C(CN2)C1CCOCC1
Complexity: 314
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 1.9
CatalogNumber:
AV18235
ChemicalName:
3-(Tetrahydro-2H-pyran-4-yl)indoline-5-carboxylic acid
CasNumber:
1160248-21-4
MolecularFormula:
C14H17NO3
MolecularWeight:
247.2897
MdlNumber:
MFCD12198794
Smiles:
OC(=O)c1ccc2c(c1)C(CN2)C1CCOCC1
Complexity:
314
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
1.9