AA63861
1458-18-0 | Methyl 3-amino-5,6-dichloropyrazine-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AA63861
ChemicalName
Methyl 3-amino-5,6-dichloropyrazine-2-carboxylate
CasNumber
1458-18-0
MolecularFormula
C6H5Cl2N3O2
MolecularWeight
222.0288
MdlNumber
MFCD00010431
Smiles
COC(=O)c1nc(Cl)c(nc1N)Cl
Complexity
204
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.1
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CatalogNumber: AA63861
ChemicalName: Methyl 3-amino-5,6-dichloropyrazine-2-carboxylate
CasNumber: 1458-18-0
MolecularFormula: C6H5Cl2N3O2
MolecularWeight: 222.0288
MdlNumber: MFCD00010431
Smiles: COC(=O)c1nc(Cl)c(nc1N)Cl
Complexity: 204
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.1
CatalogNumber:
AA63861
ChemicalName:
Methyl 3-amino-5,6-dichloropyrazine-2-carboxylate
CasNumber:
1458-18-0
MolecularFormula:
C6H5Cl2N3O2
MolecularWeight:
222.0288
MdlNumber:
MFCD00010431
Smiles:
COC(=O)c1nc(Cl)c(nc1N)Cl
Complexity:
204
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.1
CatalogNumber: AA63862
ChemicalName: Methyl 3-amino-6-iodopyrazine-2-carboxylate
CasNumber: 1458-16-8
MolecularFormula: C6H6IN3O2
MolecularWeight: 279.0352
MdlNumber: MFCD09909640
Smiles: COC(=O)c1nc(I)cnc1N
Complexity: 178
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 0.9
CatalogNumber:
AA63862
ChemicalName:
Methyl 3-amino-6-iodopyrazine-2-carboxylate
CasNumber:
1458-16-8
MolecularFormula:
C6H6IN3O2
MolecularWeight:
279.0352
MdlNumber:
MFCD09909640
Smiles:
COC(=O)c1nc(I)cnc1N
Complexity:
178
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
0.9
CatalogNumber: AA63864
ChemicalName: Methyl 3,5-diamino-6-chloropyrazine-2-carboxylate
CasNumber: 1458-01-1
MolecularFormula: C6H7ClN4O2
MolecularWeight: 202.5984
MdlNumber: MFCD01928388
Smiles: COC(=O)c1nc(Cl)c(nc1N)N
Complexity: 203
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 0.8
CatalogNumber:
AA63864
ChemicalName:
Methyl 3,5-diamino-6-chloropyrazine-2-carboxylate
CasNumber:
1458-01-1
MolecularFormula:
C6H7ClN4O2
MolecularWeight:
202.5984
MdlNumber:
MFCD01928388
Smiles:
COC(=O)c1nc(Cl)c(nc1N)N
Complexity:
203
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
0.8
CatalogNumber: __
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MolecularFormula: __
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Smiles: CC[N+](CC)(CC)CC.[F-].F.F.F.F
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CC[N+](CC)(CC)CC.[F-].F.F.F.F
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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