AI48829
35899-43-5 | (R)-L-(+)-Boc-His(Tos)-OH
Manufacturer: A2B Chem
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CatalogNumber
AI48829
ChemicalName
(R)-L-(+)-Boc-His(Tos)-OH
CasNumber
35899-43-5
MolecularFormula
C18H23N3O6S
MolecularWeight
409.4567
MdlNumber
MFCD00065967
Smiles
O=C(OC(C)(C)C)N[C@H](C(=O)O)Cc1ncn(c1)S(=O)(=O)c1ccc(cc1)C
Complexity
662
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
28
HydrogenBondAcceptorCount
7
HydrogenBondDonorCount
2
RotatableBondCount
8
Xlogp3
2.2
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CatalogNumber: AI48829
ChemicalName: (R)-L-(+)-Boc-His(Tos)-OH
CasNumber: 35899-43-5
MolecularFormula: C18H23N3O6S
MolecularWeight: 409.4567
MdlNumber: MFCD00065967
Smiles: O=C(OC(C)(C)C)N[C@H](C(=O)O)Cc1ncn(c1)S(=O)(=O)c1ccc(cc1)C
Complexity: 662
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 28
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 2
RotatableBondCount: 8
Xlogp3: 2.2
CatalogNumber:
AI48829
ChemicalName:
(R)-L-(+)-Boc-His(Tos)-OH
CasNumber:
35899-43-5
MolecularFormula:
C18H23N3O6S
MolecularWeight:
409.4567
MdlNumber:
MFCD00065967
Smiles:
O=C(OC(C)(C)C)N[C@H](C(=O)O)Cc1ncn(c1)S(=O)(=O)c1ccc(cc1)C
Complexity:
662
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
28
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
2
RotatableBondCount:
8
Xlogp3:
2.2
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Smiles: O=C(OC(C)(C)C)N[C@H](C(=O)N1CCC[C@H]1C(=O)N)Cc1ncn(c1)S(=O)(=O)c1ccc(cc1)C
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Smiles:
O=C(OC(C)(C)C)N[C@H](C(=O)N1CCC[C@H]1C(=O)N)Cc1ncn(c1)S(=O)(=O)c1ccc(cc1)C
Complexity:
__
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DefinedAtomStereocenterCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
__
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Smiles: C(=C(F)F)Cl
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Smiles:
C(=C(F)F)Cl
Complexity:
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Covalently-bondedUnitCount:
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DefinedAtomStereocenterCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: CCCCCCCC[Sn](CCCCCCCC)(CCCCCCCC)CCCCCCCC
Complexity: __
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Smiles:
CCCCCCCC[Sn](CCCCCCCC)(CCCCCCCC)CCCCCCCC
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__