AF68642
36070-79-8 | 6-Chloropyrazine-2-carboxamide
Manufacturer: A2B Chem
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CatalogNumber
AF68642
ChemicalName
6-Chloropyrazine-2-carboxamide
CasNumber
36070-79-8
MolecularFormula
C5H4ClN3O
MolecularWeight
157.55776
MdlNumber
MFCD02258395
Smiles
NC(=O)c1cncc(n1)Cl
Complexity
141
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
0.3
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CatalogNumber: AF68642
ChemicalName: 6-Chloropyrazine-2-carboxamide
CasNumber: 36070-79-8
MolecularFormula: C5H4ClN3O
MolecularWeight: 157.55776
MdlNumber: MFCD02258395
Smiles: NC(=O)c1cncc(n1)Cl
Complexity: 141
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 0.3
CatalogNumber:
AF68642
ChemicalName:
6-Chloropyrazine-2-carboxamide
CasNumber:
36070-79-8
MolecularFormula:
C5H4ClN3O
MolecularWeight:
157.55776
MdlNumber:
MFCD02258395
Smiles:
NC(=O)c1cncc(n1)Cl
Complexity:
141
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
0.3
CatalogNumber: AF68643
ChemicalName: 4-Fluoro-3-iodobenzoic acid
CasNumber: 403-18-9
MolecularFormula: C7H4FIO2
MolecularWeight: 266.0083
MdlNumber: MFCD03788556
Smiles: OC(=O)c1ccc(c(c1)I)F
Complexity: 163
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.2
CatalogNumber:
AF68643
ChemicalName:
4-Fluoro-3-iodobenzoic acid
CasNumber:
403-18-9
MolecularFormula:
C7H4FIO2
MolecularWeight:
266.0083
MdlNumber:
MFCD03788556
Smiles:
OC(=O)c1ccc(c(c1)I)F
Complexity:
163
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.2
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Smiles: OS(=O)(=O)O.Nc1ncc[nH]1
Complexity: __
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Smiles:
OS(=O)(=O)O.Nc1ncc[nH]1
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Smiles: CCCCC([C@@]1(O)CC[C@H]2[C@H](O1)CC(=O)[C@@H]2CCCCCCC(=O)O)(F)F
Complexity: __
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Smiles:
CCCCC([C@@]1(O)CC[C@H]2[C@H](O1)CC(=O)[C@@H]2CCCCCCC(=O)O)(F)F
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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