AA92284
173998-77-1 | 1-N-Boc-2-methyl-isothiourea
Manufacturer: A2B Chem
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CatalogNumber
AA92284
ChemicalName
1-N-Boc-2-methyl-isothiourea
CasNumber
173998-77-1
MolecularFormula
C7H14N2O2S
MolecularWeight
190.2633
MdlNumber
MFCD11519419
Smiles
CSC(=N)NC(=O)OC(C)(C)C
Complexity
196
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
UndefinedBondStereocenterCount
1
Xlogp3
2.1
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CatalogNumber: AA92284
ChemicalName: 1-N-Boc-2-methyl-isothiourea
CasNumber: 173998-77-1
MolecularFormula: C7H14N2O2S
MolecularWeight: 190.2633
MdlNumber: MFCD11519419
Smiles: CSC(=N)NC(=O)OC(C)(C)C
Complexity: 196
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
UndefinedBondStereocenterCount: 1
Xlogp3: 2.1
CatalogNumber:
AA92284
ChemicalName:
1-N-Boc-2-methyl-isothiourea
CasNumber:
173998-77-1
MolecularFormula:
C7H14N2O2S
MolecularWeight:
190.2633
MdlNumber:
MFCD11519419
Smiles:
CSC(=N)NC(=O)OC(C)(C)C
Complexity:
196
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
UndefinedBondStereocenterCount:
1
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NC1Cc2cc(F)ccc2CC1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedBondStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NC1Cc2cc(F)ccc2CC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedBondStereocenterCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1cc(F)c2c(c1)C(O)CC2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedBondStereocenterCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1cc(F)c2c(c1)C(O)CC2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedBondStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NCc1c[nH]c(=S)n1[C@H]1CCc2c(C1)cc(cc2F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedBondStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NCc1c[nH]c(=S)n1[C@H]1CCc2c(C1)cc(cc2F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedBondStereocenterCount:
__
Xlogp3:
__