AB20944
22916-26-3 | (S)-4-Carboxy-5,5-dimethylthiazolidine
Manufacturer: A2B Chem
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CatalogNumber
AB20944
ChemicalName
(S)-4-Carboxy-5,5-dimethylthiazolidine
CasNumber
22916-26-3
MolecularFormula
C6H11NO2S
MolecularWeight
161.22204
MdlNumber
MFCD00037512
Smiles
OC(=O)[C@@H]1NCSC1(C)C
Complexity
158
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
-1.7
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CatalogNumber: AB20944
ChemicalName: (S)-4-Carboxy-5,5-dimethylthiazolidine
CasNumber: 22916-26-3
MolecularFormula: C6H11NO2S
MolecularWeight: 161.22204
MdlNumber: MFCD00037512
Smiles: OC(=O)[C@@H]1NCSC1(C)C
Complexity: 158
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: -1.7
CatalogNumber:
AB20944
ChemicalName:
(S)-4-Carboxy-5,5-dimethylthiazolidine
CasNumber:
22916-26-3
MolecularFormula:
C6H11NO2S
MolecularWeight:
161.22204
MdlNumber:
MFCD00037512
Smiles:
OC(=O)[C@@H]1NCSC1(C)C
Complexity:
158
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
-1.7
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Smiles: O=C(c1ccccc1)OCCCCCCOC(=O)c1ccccc1
Complexity: __
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Smiles:
O=C(c1ccccc1)OCCCCCCOC(=O)c1ccccc1
Complexity:
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DefinedAtomStereocenterCount:
__
HeavyAtomCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: O=C1CSC(=NN=C2C(=O)Nc3c2cccc3)N1
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1CSC(=NN=C2C(=O)Nc3c2cccc3)N1
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(N1CCc2c(C1C(=O)O)cccc2)OCc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(N1CCc2c(C1C(=O)O)cccc2)OCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__