AB49083
56633-75-1 | (S)-2-(2-Pyrrolidinyl)acetic acid
Manufacturer: A2B Chem
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CatalogNumber
AB49083
ChemicalName
(S)-2-(2-Pyrrolidinyl)acetic acid
CasNumber
56633-75-1
MolecularFormula
C6H11NO2
MolecularWeight
129.157
MdlNumber
MFCD01863750
Smiles
OC(=O)C[C@@H]1CCCN1
Complexity
114
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
9
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
-2.4
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CatalogNumber: AB49083
ChemicalName: (S)-2-(2-Pyrrolidinyl)acetic acid
CasNumber: 56633-75-1
MolecularFormula: C6H11NO2
MolecularWeight: 129.157
MdlNumber: MFCD01863750
Smiles: OC(=O)C[C@@H]1CCCN1
Complexity: 114
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: -2.4
CatalogNumber:
AB49083
ChemicalName:
(S)-2-(2-Pyrrolidinyl)acetic acid
CasNumber:
56633-75-1
MolecularFormula:
C6H11NO2
MolecularWeight:
129.157
MdlNumber:
MFCD01863750
Smiles:
OC(=O)C[C@@H]1CCCN1
Complexity:
114
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
-2.4
CatalogNumber: AB49084
ChemicalName: Gw 788388
CasNumber: 452342-67-5
MolecularFormula: C25H23N5O2
MolecularWeight: 425.4824
MdlNumber: MFCD20527321
Smiles: O=C(c1ccc(cc1)c1nccc(c1)c1c[nH]nc1c1ccccn1)NC1CCOCC1
Complexity: 605
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 32
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 5
Xlogp3: 2.7
CatalogNumber:
AB49084
ChemicalName:
Gw 788388
CasNumber:
452342-67-5
MolecularFormula:
C25H23N5O2
MolecularWeight:
425.4824
MdlNumber:
MFCD20527321
Smiles:
O=C(c1ccc(cc1)c1nccc(c1)c1c[nH]nc1c1ccccn1)NC1CCOCC1
Complexity:
605
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
32
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
5
Xlogp3:
2.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1ccc(cc1)c1ccc(cc1)C(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1ccc(cc1)c1ccc(cc1)C(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1ccccc1S(=O)(=O)N
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1ccccc1S(=O)(=O)N
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__