AB46720
32926-43-5 | (S)-L-Boc-His(Trt)-OH
Manufacturer: A2B Chem
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CatalogNumber
AB46720
ChemicalName
(S)-L-Boc-His(Trt)-OH
CasNumber
32926-43-5
MolecularFormula
C30H31N3O4
MolecularWeight
497.5848
MdlNumber
MFCD00153307
Smiles
OC(=O)C(Cc1ncn(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1)NC(=O)OC(C)(C)C
Complexity
703
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
37
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
10
Xlogp3
5.4
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CatalogNumber: AB46720
ChemicalName: (S)-L-Boc-His(Trt)-OH
CasNumber: 32926-43-5
MolecularFormula: C30H31N3O4
MolecularWeight: 497.5848
MdlNumber: MFCD00153307
Smiles: OC(=O)C(Cc1ncn(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1)NC(=O)OC(C)(C)C
Complexity: 703
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 37
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 10
Xlogp3: 5.4
CatalogNumber:
AB46720
ChemicalName:
(S)-L-Boc-His(Trt)-OH
CasNumber:
32926-43-5
MolecularFormula:
C30H31N3O4
MolecularWeight:
497.5848
MdlNumber:
MFCD00153307
Smiles:
OC(=O)C(Cc1ncn(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1)NC(=O)OC(C)(C)C
Complexity:
703
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
37
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
10
Xlogp3:
5.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(OC(C)(C)C)NOS(=O)(=O)c1c(C)cc(cc1C)C
Complexity: 451
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3.2
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(OC(C)(C)C)NOS(=O)(=O)c1c(C)cc(cc1C)C
Complexity:
451
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3.2
CatalogNumber: AB46722
ChemicalName: N-Boc-piperidine-4-carboxylic acid
CasNumber: 84358-13-4
MolecularFormula: C11H19NO4
MolecularWeight: 229.2729
MdlNumber: MFCD00076999
Smiles: O=C(N1CCC(CC1)C(=O)O)OC(C)(C)C
Complexity: 274
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.1
CatalogNumber:
AB46722
ChemicalName:
N-Boc-piperidine-4-carboxylic acid
CasNumber:
84358-13-4
MolecularFormula:
C11H19NO4
MolecularWeight:
229.2729
MdlNumber:
MFCD00076999
Smiles:
O=C(N1CCC(CC1)C(=O)O)OC(C)(C)C
Complexity:
274
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.1
CatalogNumber: AB46723
ChemicalName: N-Boc-trans-4-hydroxy-L-prolinol
CasNumber: 61478-26-0
MolecularFormula: C10H19NO4
MolecularWeight: 217.2622
MdlNumber: MFCD00040581
Smiles: OC[C@@H]1C[C@H](CN1C(=O)OC(C)(C)C)O
Complexity: 236
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 2
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: __
CatalogNumber:
AB46723
ChemicalName:
N-Boc-trans-4-hydroxy-L-prolinol
CasNumber:
61478-26-0
MolecularFormula:
C10H19NO4
MolecularWeight:
217.2622
MdlNumber:
MFCD00040581
Smiles:
OC[C@@H]1C[C@H](CN1C(=O)OC(C)(C)C)O
Complexity:
236
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
2
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
__