AG33024
500541-40-2 | 3-(2-Oxo-1,3-thiazolidin-3-yl)propanoic acid
Manufacturer: A2B Chem
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CatalogNumber
AG33024
ChemicalName
3-(2-Oxo-1,3-thiazolidin-3-yl)propanoic acid
CasNumber
500541-40-2
MolecularFormula
C6H9NO3S
MolecularWeight
175.2056
MdlNumber
MFCD07686042
Smiles
OC(=O)CCN1CCSC1=O
NscNumber
122625
Complexity
183
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
-0.1
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CatalogNumber: AG33024
ChemicalName: 3-(2-Oxo-1,3-thiazolidin-3-yl)propanoic acid
CasNumber: 500541-40-2
MolecularFormula: C6H9NO3S
MolecularWeight: 175.2056
MdlNumber: MFCD07686042
Smiles: OC(=O)CCN1CCSC1=O
NscNumber: 122625
Complexity: 183
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: -0.1
CatalogNumber:
AG33024
ChemicalName:
3-(2-Oxo-1,3-thiazolidin-3-yl)propanoic acid
CasNumber:
500541-40-2
MolecularFormula:
C6H9NO3S
MolecularWeight:
175.2056
MdlNumber:
MFCD07686042
Smiles:
OC(=O)CCN1CCSC1=O
NscNumber:
122625
Complexity:
183
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
-0.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C[C@H](N1CC(CC1=O)C(=O)O)c1ccccc1
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C[C@H](N1CC(CC1=O)C(=O)O)c1ccccc1
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AG33027
ChemicalName: 1,4-Dipiperazino-2,3,5,6-tetrafluorobenzene
CasNumber: 502616-02-6
MolecularFormula: C14H18F4N4
MolecularWeight: 318.3131327999999
MdlNumber: MFCD22586679
Smiles: Fc1c(N2CCNCC2)c(F)c(c(c1F)N1CCNCC1)F
NscNumber: __
Complexity: 313
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 8
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 1.3
CatalogNumber:
AG33027
ChemicalName:
1,4-Dipiperazino-2,3,5,6-tetrafluorobenzene
CasNumber:
502616-02-6
MolecularFormula:
C14H18F4N4
MolecularWeight:
318.3131327999999
MdlNumber:
MFCD22586679
Smiles:
Fc1c(N2CCNCC2)c(F)c(c(c1F)N1CCNCC1)F
NscNumber:
__
Complexity:
313
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
8
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
1.3
CatalogNumber: AG33028
ChemicalName: 3(5)-Isopropyl-4-nitro-1h-pyrazole
CasNumber: 51355-77-2
MolecularFormula: C6H9N3O2
MolecularWeight: 155.15455999999998
MdlNumber: MFCD14657963
Smiles: CC(c1n[nH]cc1N(=O)=O)C
NscNumber: __
Complexity: 154
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.2
CatalogNumber:
AG33028
ChemicalName:
3(5)-Isopropyl-4-nitro-1h-pyrazole
CasNumber:
51355-77-2
MolecularFormula:
C6H9N3O2
MolecularWeight:
155.15455999999998
MdlNumber:
MFCD14657963
Smiles:
CC(c1n[nH]cc1N(=O)=O)C
NscNumber:
__
Complexity:
154
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.2