AB54403
486460-21-3 | 3-(trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine
Manufacturer: A2B Chem
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CatalogNumber
AB54403
ChemicalName
3-(trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine
CasNumber
486460-21-3
MolecularFormula
C6H7F3N4
MolecularWeight
192.14178959999998
MdlNumber
MFCD08460920
Smiles
FC(c1nnc2n1CCNC2)(F)F
Complexity
195
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
Xlogp3
-0.5
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CatalogNumber: AB54403
ChemicalName: 3-(trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine
CasNumber: 486460-21-3
MolecularFormula: C6H7F3N4
MolecularWeight: 192.14178959999998
MdlNumber: MFCD08460920
Smiles: FC(c1nnc2n1CCNC2)(F)F
Complexity: 195
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
Xlogp3: -0.5
CatalogNumber:
AB54403
ChemicalName:
3-(trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine
CasNumber:
486460-21-3
MolecularFormula:
C6H7F3N4
MolecularWeight:
192.14178959999998
MdlNumber:
MFCD08460920
Smiles:
FC(c1nnc2n1CCNC2)(F)F
Complexity:
195
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
Xlogp3:
-0.5
CatalogNumber: AB54404
ChemicalName: 3-(Trifluoromethyl)benzophenone
CasNumber: 728-81-4
MolecularFormula: C14H9F3O
MolecularWeight: 250.2159
MdlNumber: MFCD00000389
Smiles: O=C(c1cccc(c1)C(F)(F)F)c1ccccc1
Complexity: 292
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
Xlogp3: 4.1
CatalogNumber:
AB54404
ChemicalName:
3-(Trifluoromethyl)benzophenone
CasNumber:
728-81-4
MolecularFormula:
C14H9F3O
MolecularWeight:
250.2159
MdlNumber:
MFCD00000389
Smiles:
O=C(c1cccc(c1)C(F)(F)F)c1ccccc1
Complexity:
292
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
Xlogp3:
4.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NNc1cccc(c1)C(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NNc1cccc(c1)C(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
__
CatalogNumber: AB54406
ChemicalName: 3,3'-Diindolylmethane
CasNumber: 1968-05-4
MolecularFormula: C17H14N2
MolecularWeight: 246.30646000000002
MdlNumber: MFCD00195766
Smiles: c1ccc2c(c1)c(c[nH]2)Cc1c[nH]c2c1cccc2
Complexity: 286
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: 2
Xlogp3: 4.3
CatalogNumber:
AB54406
ChemicalName:
3,3'-Diindolylmethane
CasNumber:
1968-05-4
MolecularFormula:
C17H14N2
MolecularWeight:
246.30646000000002
MdlNumber:
MFCD00195766
Smiles:
c1ccc2c(c1)c(c[nH]2)Cc1c[nH]c2c1cccc2
Complexity:
286
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
2
Xlogp3:
4.3