AB79005
108179-91-5 | SKF 83566 hydrobromide
Manufacturer: A2B Chem
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CatalogNumber
AB79005
ChemicalName
SKF 83566 hydrobromide
CasNumber
108179-91-5
MolecularFormula
C17H19Br2NO
MolecularWeight
413.1469
MdlNumber
MFCD04039787
Smiles
CN1CCc2c(C(C1)c1ccccc1)cc(c(c2)Br)O.Br
Complexity
318
Covalently-bondedUnitCount
2
HeavyAtomCount
21
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
2
RotatableBondCount
1
UndefinedAtomStereocenterCount
1
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CatalogNumber: AB79005
ChemicalName: SKF 83566 hydrobromide
CasNumber: 108179-91-5
MolecularFormula: C17H19Br2NO
MolecularWeight: 413.1469
MdlNumber: MFCD04039787
Smiles: CN1CCc2c(C(C1)c1ccccc1)cc(c(c2)Br)O.Br
Complexity: 318
Covalently-bondedUnitCount: 2
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 1
UndefinedAtomStereocenterCount: 1
CatalogNumber:
AB79005
ChemicalName:
SKF 83566 hydrobromide
CasNumber:
108179-91-5
MolecularFormula:
C17H19Br2NO
MolecularWeight:
413.1469
MdlNumber:
MFCD04039787
Smiles:
CN1CCc2c(C(C1)c1ccccc1)cc(c(c2)Br)O.Br
Complexity:
318
Covalently-bondedUnitCount:
2
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C([C@@H]1CC[C@H](CC1)CN1C(=O)C=CC1=O)ON1C(=O)CCC1=O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C([C@@H]1CC[C@H](CC1)CN1C(=O)C=CC1=O)ON1C(=O)CCC1=O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CSC(=NS(=O)(=O)OCC(Cl)(Cl)Cl)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CSC(=NS(=O)(=O)OCC(Cl)(Cl)Cl)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
CatalogNumber: AB79008
ChemicalName: S-Methyl thiazole-4-carbothioate
CasNumber: 913836-23-4
MolecularFormula: C5H5NOS2
MolecularWeight: 159.2293
MdlNumber: MFCD08689508
Smiles: CSC(=O)c1cscn1
Complexity: 118
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 2
UndefinedAtomStereocenterCount: __
CatalogNumber:
AB79008
ChemicalName:
S-Methyl thiazole-4-carbothioate
CasNumber:
913836-23-4
MolecularFormula:
C5H5NOS2
MolecularWeight:
159.2293
MdlNumber:
MFCD08689508
Smiles:
CSC(=O)c1cscn1
Complexity:
118
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
__