AB50955
5718-83-2 | Rhodanine-3-acetic acid
Manufacturer: A2B Chem
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CatalogNumber
AB50955
ChemicalName
Rhodanine-3-acetic acid
CasNumber
5718-83-2
MolecularFormula
C5H5NO3S2
MolecularWeight
191.2281
MdlNumber
MFCD06199283
Smiles
OC(=O)CN1C(=S)SCC1=O
NscNumber
40450
Complexity
228
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
0.4
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CatalogNumber: AB50955
ChemicalName: Rhodanine-3-acetic acid
CasNumber: 5718-83-2
MolecularFormula: C5H5NO3S2
MolecularWeight: 191.2281
MdlNumber: MFCD06199283
Smiles: OC(=O)CN1C(=S)SCC1=O
NscNumber: 40450
Complexity: 228
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 0.4
CatalogNumber:
AB50955
ChemicalName:
Rhodanine-3-acetic acid
CasNumber:
5718-83-2
MolecularFormula:
C5H5NO3S2
MolecularWeight:
191.2281
MdlNumber:
MFCD06199283
Smiles:
OC(=O)CN1C(=S)SCC1=O
NscNumber:
40450
Complexity:
228
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
0.4
CatalogNumber: AB50956
ChemicalName: Furo[3,4-b]pyridin-5(7h)-one
CasNumber: 5657-51-2
MolecularFormula: C7H5NO2
MolecularWeight: 135.1201
MdlNumber: MFCD01860224
Smiles: O=C1OCc2c1cccn2
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AB50956
ChemicalName:
Furo[3,4-b]pyridin-5(7h)-one
CasNumber:
5657-51-2
MolecularFormula:
C7H5NO2
MolecularWeight:
135.1201
MdlNumber:
MFCD01860224
Smiles:
O=C1OCc2c1cccn2
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)[C@@H]1CCCN1C(=O)CNC12CC3CC(C1)CC(C2)(C3)O
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)[C@@H]1CCCN1C(=O)CNC12CC3CC(C1)CC(C2)(C3)O
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB50958
ChemicalName: Dihydroresveratrol
CasNumber: 58436-28-5
MolecularFormula: C14H14O3
MolecularWeight: 230.2592
MdlNumber: MFCD25973128
Smiles: Oc1ccc(cc1)CCc1cc(O)cc(c1)O
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AB50958
ChemicalName:
Dihydroresveratrol
CasNumber:
58436-28-5
MolecularFormula:
C14H14O3
MolecularWeight:
230.2592
MdlNumber:
MFCD25973128
Smiles:
Oc1ccc(cc1)CCc1cc(O)cc(c1)O
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__