AB01233
178734-54-8 | (S)-Methyl 2-((S)-2-((tert-butoxycarbonyl)(methyl)amino)propanamido)-3-methylbutanoate
Manufacturer: A2B Chem
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CatalogNumber
AB01233
ChemicalName
(S)-Methyl 2-((S)-2-((tert-butoxycarbonyl)(methyl)amino)propanamido)-3-methylbutanoate
CasNumber
178734-54-8
MolecularFormula
C15H28N2O5
MolecularWeight
316.3932
MdlNumber
MFCD22123517
Smiles
COC(=O)[C@H](C(C)C)NC(=O)[C@@H](N(C(=O)OC(C)(C)C)C)C
Complexity
415
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
2
HeavyAtomCount
22
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
8
Xlogp3
2.1
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CatalogNumber: AB01233
ChemicalName: (S)-Methyl 2-((S)-2-((tert-butoxycarbonyl)(methyl)amino)propanamido)-3-methylbutanoate
CasNumber: 178734-54-8
MolecularFormula: C15H28N2O5
MolecularWeight: 316.3932
MdlNumber: MFCD22123517
Smiles: COC(=O)[C@H](C(C)C)NC(=O)[C@@H](N(C(=O)OC(C)(C)C)C)C
Complexity: 415
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 2
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 8
Xlogp3: 2.1
CatalogNumber:
AB01233
ChemicalName:
(S)-Methyl 2-((S)-2-((tert-butoxycarbonyl)(methyl)amino)propanamido)-3-methylbutanoate
CasNumber:
178734-54-8
MolecularFormula:
C15H28N2O5
MolecularWeight:
316.3932
MdlNumber:
MFCD22123517
Smiles:
COC(=O)[C@H](C(C)C)NC(=O)[C@@H](N(C(=O)OC(C)(C)C)C)C
Complexity:
415
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
2
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
8
Xlogp3:
2.1
CatalogNumber: AB01236
ChemicalName: 5-(Methoxycarbonyl)pyridine-2-carboxylic acid
CasNumber: 17874-79-2
MolecularFormula: C8H7NO4
MolecularWeight: 181.1455
MdlNumber: MFCD00179343
Smiles: COC(=O)c1ccc(nc1)C(=O)O
Complexity: 216
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 0.6
CatalogNumber:
AB01236
ChemicalName:
5-(Methoxycarbonyl)pyridine-2-carboxylic acid
CasNumber:
17874-79-2
MolecularFormula:
C8H7NO4
MolecularWeight:
181.1455
MdlNumber:
MFCD00179343
Smiles:
COC(=O)c1ccc(nc1)C(=O)O
Complexity:
216
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
0.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)c1ccc(cn1)C(=O)[O-]
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)c1ccc(cn1)C(=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB01238
ChemicalName: 2-Methyl hydrogen pyridine-2,5-dicarboxylate
CasNumber: 17874-76-9
MolecularFormula: C8H7NO4
MolecularWeight: 181.1455
MdlNumber: MFCD09702182
Smiles: COC(=O)c1ccc(cn1)C(=O)O
Complexity: 216
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 0.6
CatalogNumber:
AB01238
ChemicalName:
2-Methyl hydrogen pyridine-2,5-dicarboxylate
CasNumber:
17874-76-9
MolecularFormula:
C8H7NO4
MolecularWeight:
181.1455
MdlNumber:
MFCD09702182
Smiles:
COC(=O)c1ccc(cn1)C(=O)O
Complexity:
216
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
0.6