AB08055
198470-36-9 | Boc-D-Pen(pMeBzl)-OH��dcha
Manufacturer: A2B Chem
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CatalogNumber
AB08055
ChemicalName
Boc-D-Pen(pMeBzl)-OH��dcha
CasNumber
198470-36-9
MolecularFormula
C18H27NO4S
MolecularWeight
353.4763
MdlNumber
MFCD00235908
Smiles
O=C(OC(C)(C)C)N[C@H](C(SCc1ccc(cc1)C)(C)C)C(=O)O
Complexity
553
Covalently-bondedUnitCount
2
DefinedAtomStereocenterCount
1
HeavyAtomCount
37
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
3
RotatableBondCount
10
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CatalogNumber: AB08055
ChemicalName: Boc-D-Pen(pMeBzl)-OH��dcha
CasNumber: 198470-36-9
MolecularFormula: C18H27NO4S
MolecularWeight: 353.4763
MdlNumber: MFCD00235908
Smiles: O=C(OC(C)(C)C)N[C@H](C(SCc1ccc(cc1)C)(C)C)C(=O)O
Complexity: 553
Covalently-bondedUnitCount: 2
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 37
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 3
RotatableBondCount: 10
CatalogNumber:
AB08055
ChemicalName:
Boc-D-Pen(pMeBzl)-OH��dcha
CasNumber:
198470-36-9
MolecularFormula:
C18H27NO4S
MolecularWeight:
353.4763
MdlNumber:
MFCD00235908
Smiles:
O=C(OC(C)(C)C)N[C@H](C(SCc1ccc(cc1)C)(C)C)C(=O)O
Complexity:
553
Covalently-bondedUnitCount:
2
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
37
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
3
RotatableBondCount:
10
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C1CCC(CC1)NC1CCCCC1.OC(=O)[C@H](NC(=O)OC(C)(C)C)CC1CCCCC1
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C1CCC(CC1)NC1CCCCC1.OC(=O)[C@H](NC(=O)OC(C)(C)C)CC1CCCCC1
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AB08062
ChemicalName: 2-Cyanopyrazine
CasNumber: 19847-12-2
MolecularFormula: C5H3N3
MolecularWeight: 105.0974
MdlNumber: MFCD00049361
Smiles: c1nccnc1C#N
Complexity: 112
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
AB08062
ChemicalName:
2-Cyanopyrazine
CasNumber:
19847-12-2
MolecularFormula:
C5H3N3
MolecularWeight:
105.0974
MdlNumber:
MFCD00049361
Smiles:
c1nccnc1C#N
Complexity:
112
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1scc(n1)c1nccnc1
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1scc(n1)c1nccnc1
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__