AB48166
80154-63-8 | (S)-2-(3-Methylbutanamido)pentanedioic acid
Manufacturer: A2B Chem
The price for this product is unavailable. Please request a quote
CatalogNumber
AB48166
ChemicalName
(S)-2-(3-Methylbutanamido)pentanedioic acid
CasNumber
80154-63-8
MolecularFormula
C10H17NO5
MolecularWeight
231.2457
MdlNumber
MFCD12795615
Smiles
CC(CC(=O)N[C@H](C(=O)O)CCC(=O)O)C
Complexity
274
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
3
RotatableBondCount
7
Xlogp3
-0.6
Related Products
Compare Similar Items
Show Difference
CatalogNumber: AB48166
ChemicalName: (S)-2-(3-Methylbutanamido)pentanedioic acid
CasNumber: 80154-63-8
MolecularFormula: C10H17NO5
MolecularWeight: 231.2457
MdlNumber: MFCD12795615
Smiles: CC(CC(=O)N[C@H](C(=O)O)CCC(=O)O)C
Complexity: 274
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 3
RotatableBondCount: 7
Xlogp3: -0.6
CatalogNumber:
AB48166
ChemicalName:
(S)-2-(3-Methylbutanamido)pentanedioic acid
CasNumber:
80154-63-8
MolecularFormula:
C10H17NO5
MolecularWeight:
231.2457
MdlNumber:
MFCD12795615
Smiles:
CC(CC(=O)N[C@H](C(=O)O)CCC(=O)O)C
Complexity:
274
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
3
RotatableBondCount:
7
Xlogp3:
-0.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1ccc2c(c1)Sc1c(S2)cc(cc1)F
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1ccc2c(c1)Sc1c(S2)cc(cc1)F
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB48168
ChemicalName: 2-Amino-3-chloro-5-nitrobenzoic acid
CasNumber: 773109-32-3
MolecularFormula: C7H5ClN2O4
MolecularWeight: 216.5786
MdlNumber: MFCD06208323
Smiles: [O-][N+](=O)c1cc(Cl)c(c(c1)C(=O)O)N
Complexity: 255
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 1.8
CatalogNumber:
AB48168
ChemicalName:
2-Amino-3-chloro-5-nitrobenzoic acid
CasNumber:
773109-32-3
MolecularFormula:
C7H5ClN2O4
MolecularWeight:
216.5786
MdlNumber:
MFCD06208323
Smiles:
[O-][N+](=O)c1cc(Cl)c(c(c1)C(=O)O)N
Complexity:
255
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
1.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)CC[C@H]([C@H]1CC[C@@H]2[C@]1(C)C(=O)C[C@H]1[C@H]2C(=O)C[C@H]2[C@]1(C)CCC(=O)C2)C
Complexity: 756
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.6
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)CC[C@H]([C@H]1CC[C@@H]2[C@]1(C)C(=O)C[C@H]1[C@H]2C(=O)C[C@H]2[C@]1(C)CCC(=O)C2)C
Complexity:
756
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.6