AB52210
961-07-9 | 2-Amino-9-[4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-1,9-dihydro-6h-purin-6-one
Manufacturer: A2B Chem
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CatalogNumber
AB52210
ChemicalName
2-Amino-9-[4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-1,9-dihydro-6h-purin-6-one
CasNumber
961-07-9
MolecularFormula
C10H13N5O4
MolecularWeight
267.2413
MdlNumber
MFCD00150760
Smiles
OC[C@H]1O[C@H](C[C@@H]1O)n1cnc2c1[nH]c(N)nc2=O
Complexity
417
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
3
HeavyAtomCount
19
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
4
RotatableBondCount
2
Xlogp3
-0.9
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CatalogNumber: AB52210
ChemicalName: 2-Amino-9-[4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-1,9-dihydro-6h-purin-6-one
CasNumber: 961-07-9
MolecularFormula: C10H13N5O4
MolecularWeight: 267.2413
MdlNumber: MFCD00150760
Smiles: OC[C@H]1O[C@H](C[C@@H]1O)n1cnc2c1[nH]c(N)nc2=O
Complexity: 417
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 3
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 4
RotatableBondCount: 2
Xlogp3: -0.9
CatalogNumber:
AB52210
ChemicalName:
2-Amino-9-[4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-1,9-dihydro-6h-purin-6-one
CasNumber:
961-07-9
MolecularFormula:
C10H13N5O4
MolecularWeight:
267.2413
MdlNumber:
MFCD00150760
Smiles:
OC[C@H]1O[C@H](C[C@@H]1O)n1cnc2c1[nH]c(N)nc2=O
Complexity:
417
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
3
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
4
RotatableBondCount:
2
Xlogp3:
-0.9
CatalogNumber: AB52211
ChemicalName: 2,2'-Anhydro-1(B-D-arabinofuranosyl)uracil
CasNumber: 3736-77-4
MolecularFormula: C9H10N2O5
MolecularWeight: 226.1861
MdlNumber: MFCD00004945
Smiles: OC[C@H]1O[C@@H]2[C@H]([C@@H]1O)Oc1n2ccc(=O)n1
Complexity: 393
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 4
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: -2.5
CatalogNumber:
AB52211
ChemicalName:
2,2'-Anhydro-1(B-D-arabinofuranosyl)uracil
CasNumber:
3736-77-4
MolecularFormula:
C9H10N2O5
MolecularWeight:
226.1861
MdlNumber:
MFCD00004945
Smiles:
OC[C@H]1O[C@@H]2[C@H]([C@@H]1O)Oc1n2ccc(=O)n1
Complexity:
393
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
4
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
-2.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCCc1c[nH]c2c1cccc2CC
Complexity: 183
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.4
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
OCCc1c[nH]c2c1cccc2CC
Complexity:
183
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1cccnc1Nc1cccc(c1C)Cl.NCCCC[C@@H](C(=O)O)N
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1cccnc1Nc1cccc(c1C)Cl.NCCCC[C@@H](C(=O)O)N
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__