AI40143
1820581-42-7 | 3-tert-butyl 4-methyl (4S)-1,3-thiazolidine-3,4-dicarboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI40143
ChemicalName
3-tert-butyl 4-methyl (4S)-1,3-thiazolidine-3,4-dicarboxylate
CasNumber
1820581-42-7
MolecularFormula
C10H17NO4S
MolecularWeight
247.3113
MdlNumber
MFCD27578216
Smiles
COC(=O)[C@H]1CSCN1C(=O)OC(C)(C)C
Complexity
287
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
5
RotatableBondCount
4
Xlogp3
1.6
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CatalogNumber: AI40143
ChemicalName: 3-tert-butyl 4-methyl (4S)-1,3-thiazolidine-3,4-dicarboxylate
CasNumber: 1820581-42-7
MolecularFormula: C10H17NO4S
MolecularWeight: 247.3113
MdlNumber: MFCD27578216
Smiles: COC(=O)[C@H]1CSCN1C(=O)OC(C)(C)C
Complexity: 287
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 5
RotatableBondCount: 4
Xlogp3: 1.6
CatalogNumber:
AI40143
ChemicalName:
3-tert-butyl 4-methyl (4S)-1,3-thiazolidine-3,4-dicarboxylate
CasNumber:
1820581-42-7
MolecularFormula:
C10H17NO4S
MolecularWeight:
247.3113
MdlNumber:
MFCD27578216
Smiles:
COC(=O)[C@H]1CSCN1C(=O)OC(C)(C)C
Complexity:
287
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
5
RotatableBondCount:
4
Xlogp3:
1.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)[C@@H](NC(=O)OCC1c2ccccc2-c2c1cccc2)CCCNC(=O)N
Complexity: 592
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)[C@@H](NC(=O)OCC1c2ccccc2-c2c1cccc2)CCCNC(=O)N
Complexity:
592
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)[C@H](Cc1nc2c(s1)cccc2)N.Cl
Complexity: 250
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)[C@H](Cc1nc2c(s1)cccc2)N.Cl
Complexity:
250
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)[C@H](NC(=O)OC(C)(C)C)CCCNC(=O)OCc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)[C@H](NC(=O)OC(C)(C)C)CCCNC(=O)OCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__