AI37556
1567995-93-0 | Ethyl 1,3-dioxo-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine-4-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI37556
ChemicalName
Ethyl 1,3-dioxo-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine-4-carboxylate
CasNumber
1567995-93-0
MolecularFormula
C10H10N2O4
MolecularWeight
222.1974
MdlNumber
MFCD28390428
Smiles
CCOC(=O)C1C(=O)NC(=O)c2n1ccc2
Complexity
342
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
UndefinedAtomStereocenterCount
1
Xlogp3
0.4
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CatalogNumber: AI37556
ChemicalName: Ethyl 1,3-dioxo-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine-4-carboxylate
CasNumber: 1567995-93-0
MolecularFormula: C10H10N2O4
MolecularWeight: 222.1974
MdlNumber: MFCD28390428
Smiles: CCOC(=O)C1C(=O)NC(=O)c2n1ccc2
Complexity: 342
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 1
Xlogp3: 0.4
CatalogNumber:
AI37556
ChemicalName:
Ethyl 1,3-dioxo-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine-4-carboxylate
CasNumber:
1567995-93-0
MolecularFormula:
C10H10N2O4
MolecularWeight:
222.1974
MdlNumber:
MFCD28390428
Smiles:
CCOC(=O)C1C(=O)NC(=O)c2n1ccc2
Complexity:
342
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
1
Xlogp3:
0.4
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Smiles: O[C@@H](C(F)(F)F)C1CC1
Complexity: __
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Smiles:
O[C@@H](C(F)(F)F)C1CC1
Complexity:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
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Xlogp3:
__
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MolecularFormula: __
MolecularWeight: __
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Smiles: CC[C@H](C(=O)N1CCC(CC1)O)NC(C(=O)N1CCC(CC1)O)(CC)N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CC[C@H](C(=O)N1CCC(CC1)O)NC(C(=O)N1CCC(CC1)O)(CC)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O[C@H](C(F)(F)F)C1CC1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O[C@H](C(F)(F)F)C1CC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__