AE92408
154-87-0 | 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(2-{[hydroxy(phosphonooxy)phosphoryl]oxy}ethyl)-4-methyl-1,3-thiazol-3-ium chloride
Manufacturer: A2B Chem
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CatalogNumber
AE92408
ChemicalName
3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(2-{[hydroxy(phosphonooxy)phosphoryl]oxy}ethyl)-4-methyl-1,3-thiazol-3-ium chloride
CasNumber
154-87-0
MolecularFormula
C12H19ClN4O7P2S
MolecularWeight
460.76738200000005
MdlNumber
MFCD00038740
Smiles
Cc1ncc(c(n1)N)C[n+]1csc(c1C)CCOP(=O)(OP(=O)(O)O)O.[Cl-]
Complexity
568
Covalently-bondedUnitCount
2
HeavyAtomCount
27
HydrogenBondAcceptorCount
12
HydrogenBondDonorCount
4
RotatableBondCount
8
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CatalogNumber: AE92408
ChemicalName: 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(2-{[hydroxy(phosphonooxy)phosphoryl]oxy}ethyl)-4-methyl-1,3-thiazol-3-ium chloride
CasNumber: 154-87-0
MolecularFormula: C12H19ClN4O7P2S
MolecularWeight: 460.76738200000005
MdlNumber: MFCD00038740
Smiles: Cc1ncc(c(n1)N)C[n+]1csc(c1C)CCOP(=O)(OP(=O)(O)O)O.[Cl-]
Complexity: 568
Covalently-bondedUnitCount: 2
HeavyAtomCount: 27
HydrogenBondAcceptorCount: 12
HydrogenBondDonorCount: 4
RotatableBondCount: 8
CatalogNumber:
AE92408
ChemicalName:
3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(2-{[hydroxy(phosphonooxy)phosphoryl]oxy}ethyl)-4-methyl-1,3-thiazol-3-ium chloride
CasNumber:
154-87-0
MolecularFormula:
C12H19ClN4O7P2S
MolecularWeight:
460.76738200000005
MdlNumber:
MFCD00038740
Smiles:
Cc1ncc(c(n1)N)C[n+]1csc(c1C)CCOP(=O)(OP(=O)(O)O)O.[Cl-]
Complexity:
568
Covalently-bondedUnitCount:
2
HeavyAtomCount:
27
HydrogenBondAcceptorCount:
12
HydrogenBondDonorCount:
4
RotatableBondCount:
8
CatalogNumber: __
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Smiles: N[C@H](C(=O)O)CCN.Cl
Complexity: __
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Smiles:
N[C@H](C(=O)O)CCN.Cl
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Smiles: C1COCCC1=O
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Smiles:
C1COCCC1=O
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Smiles: CC(=O)Nc1nc2c(s1)cc(cc2)Br
Complexity: 239
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ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
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MdlNumber:
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Smiles:
CC(=O)Nc1nc2c(s1)cc(cc2)Br
Complexity:
239
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__