AB73904
34859-64-8 | 5-Aminoisoxazole-4-carboxylic acid ethyl ester
Manufacturer: A2B Chem
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CatalogNumber
AB73904
ChemicalName
5-Aminoisoxazole-4-carboxylic acid ethyl ester
CasNumber
34859-64-8
MolecularFormula
C6H8N2O3
MolecularWeight
156.1393
MdlNumber
MFCD00014093
Smiles
CCOC(=O)c1cnoc1N
Complexity
151
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
0.8
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CatalogNumber: AB73904
ChemicalName: 5-Aminoisoxazole-4-carboxylic acid ethyl ester
CasNumber: 34859-64-8
MolecularFormula: C6H8N2O3
MolecularWeight: 156.1393
MdlNumber: MFCD00014093
Smiles: CCOC(=O)c1cnoc1N
Complexity: 151
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 0.8
CatalogNumber:
AB73904
ChemicalName:
5-Aminoisoxazole-4-carboxylic acid ethyl ester
CasNumber:
34859-64-8
MolecularFormula:
C6H8N2O3
MolecularWeight:
156.1393
MdlNumber:
MFCD00014093
Smiles:
CCOC(=O)c1cnoc1N
Complexity:
151
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
0.8
CatalogNumber: AB73905
ChemicalName: Ethyl 5-aminothieno[2,3-d]pyrimidine-6-carboxylate
CasNumber: 59488-80-1
MolecularFormula: C9H9N3O2S
MolecularWeight: 223.2517
MdlNumber: MFCD22683327
Smiles: CCOC(=O)c1sc2c(c1N)cncn2
Complexity: 252
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2
CatalogNumber:
AB73905
ChemicalName:
Ethyl 5-aminothieno[2,3-d]pyrimidine-6-carboxylate
CasNumber:
59488-80-1
MolecularFormula:
C9H9N3O2S
MolecularWeight:
223.2517
MdlNumber:
MFCD22683327
Smiles:
CCOC(=O)c1sc2c(c1N)cncn2
Complexity:
252
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)c1sc2c(n1)CCN(C2)C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)c1sc2c(n1)CCN(C2)C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB73907
ChemicalName: Ethyl 5-bromo-1H-1,2,4-triazole-3-carboxylate
CasNumber: 774608-89-8
MolecularFormula: C5H6BrN3O2
MolecularWeight: 220.024
MdlNumber: MFCD11040185
Smiles: CCOC(=O)c1n[nH]c(n1)Br
Complexity: 155
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.6
CatalogNumber:
AB73907
ChemicalName:
Ethyl 5-bromo-1H-1,2,4-triazole-3-carboxylate
CasNumber:
774608-89-8
MolecularFormula:
C5H6BrN3O2
MolecularWeight:
220.024
MdlNumber:
MFCD11040185
Smiles:
CCOC(=O)c1n[nH]c(n1)Br
Complexity:
155
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.6