AB66550
770-30-9 | 4-Amino-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Manufacturer: A2B Chem
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CatalogNumber
AB66550
ChemicalName
4-Amino-2-(methylsulfanyl)pyrimidine-5-carbonitrile
CasNumber
770-30-9
MolecularFormula
C6H6N4S
MolecularWeight
166.2036
MdlNumber
MFCD00023237
Smiles
CSc1ncc(c(n1)N)C#N
NscNumber
165363
Complexity
175
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1
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CatalogNumber: AB66550
ChemicalName: 4-Amino-2-(methylsulfanyl)pyrimidine-5-carbonitrile
CasNumber: 770-30-9
MolecularFormula: C6H6N4S
MolecularWeight: 166.2036
MdlNumber: MFCD00023237
Smiles: CSc1ncc(c(n1)N)C#N
NscNumber: 165363
Complexity: 175
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1
CatalogNumber:
AB66550
ChemicalName:
4-Amino-2-(methylsulfanyl)pyrimidine-5-carbonitrile
CasNumber:
770-30-9
MolecularFormula:
C6H6N4S
MolecularWeight:
166.2036
MdlNumber:
MFCD00023237
Smiles:
CSc1ncc(c(n1)N)C#N
NscNumber:
165363
Complexity:
175
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1
CatalogNumber: AB66551
ChemicalName: 4-Amino-2,2-difluoro-1,3-benzodioxole
CasNumber: 106876-54-4
MolecularFormula: C7H5F2NO2
MolecularWeight: 173.1169
MdlNumber: MFCD00792416
Smiles: Nc1cccc2c1OC(O2)(F)F
NscNumber: __
Complexity: 188
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: __
Xlogp3: 1.8
CatalogNumber:
AB66551
ChemicalName:
4-Amino-2,2-difluoro-1,3-benzodioxole
CasNumber:
106876-54-4
MolecularFormula:
C7H5F2NO2
MolecularWeight:
173.1169
MdlNumber:
MFCD00792416
Smiles:
Nc1cccc2c1OC(O2)(F)F
NscNumber:
__
Complexity:
188
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
__
Xlogp3:
1.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1c(N)c(F)c(c(c1F)C(=O)N)F
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1c(N)c(F)c(c(c1F)C(=O)N)F
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1c(N)c(F)c(c(c1F)C(=O)O)F
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1c(N)c(F)c(c(c1F)C(=O)O)F
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__