AB84323
89336-46-9 | (2-tert-Butoxycarbonylamino-thiazol-4-yl)-acetic acid
Manufacturer: A2B Chem
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CatalogNumber
AB84323
ChemicalName
(2-tert-Butoxycarbonylamino-thiazol-4-yl)-acetic acid
CasNumber
89336-46-9
MolecularFormula
C10H14N2O4S
MolecularWeight
258.29416000000003
MdlNumber
MFCD02682394
Smiles
O=C(Nc1scc(n1)CC(=O)O)OC(C)(C)C
Complexity
303
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
2
RotatableBondCount
5
Xlogp3
1.3
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CatalogNumber: AB84323
ChemicalName: (2-tert-Butoxycarbonylamino-thiazol-4-yl)-acetic acid
CasNumber: 89336-46-9
MolecularFormula: C10H14N2O4S
MolecularWeight: 258.29416000000003
MdlNumber: MFCD02682394
Smiles: O=C(Nc1scc(n1)CC(=O)O)OC(C)(C)C
Complexity: 303
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 5
Xlogp3: 1.3
CatalogNumber:
AB84323
ChemicalName:
(2-tert-Butoxycarbonylamino-thiazol-4-yl)-acetic acid
CasNumber:
89336-46-9
MolecularFormula:
C10H14N2O4S
MolecularWeight:
258.29416000000003
MdlNumber:
MFCD02682394
Smiles:
O=C(Nc1scc(n1)CC(=O)O)OC(C)(C)C
Complexity:
303
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
5
Xlogp3:
1.3
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Smiles: O=C1CSC(=N1)Nc1nnc(s1)c1ccccc1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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Smiles:
O=C1CSC(=N1)Nc1nnc(s1)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: Cc1ccc(cc1)S(=O)(=O)O.OCCCCCCCCCC#C
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Smiles:
Cc1ccc(cc1)S(=O)(=O)O.OCCCCCCCCCC#C
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: COc1c(OC)c(OC)cc2c1C(CC(=O)O2)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
COc1c(OC)c(OC)cc2c1C(CC(=O)O2)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__