AF60204
34859-65-9 | Ethyl 5-amino-3-methylisothiazole-4-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AF60204
ChemicalName
Ethyl 5-amino-3-methylisothiazole-4-carboxylate
CasNumber
34859-65-9
MolecularFormula
C7H10N2O2S
MolecularWeight
186.2315
MdlNumber
MFCD00097916
Smiles
CCOC(=O)c1c(N)snc1C
Complexity
177
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
1.8
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CatalogNumber: AF60204
ChemicalName: Ethyl 5-amino-3-methylisothiazole-4-carboxylate
CasNumber: 34859-65-9
MolecularFormula: C7H10N2O2S
MolecularWeight: 186.2315
MdlNumber: MFCD00097916
Smiles: CCOC(=O)c1c(N)snc1C
Complexity: 177
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.8
CatalogNumber:
AF60204
ChemicalName:
Ethyl 5-amino-3-methylisothiazole-4-carboxylate
CasNumber:
34859-65-9
MolecularFormula:
C7H10N2O2S
MolecularWeight:
186.2315
MdlNumber:
MFCD00097916
Smiles:
CCOC(=O)c1c(N)snc1C
Complexity:
177
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.8
CatalogNumber: AF60205
ChemicalName: 2-Acetyl-3-bromothiophene
CasNumber: 42877-08-7
MolecularFormula: C6H5BrOS
MolecularWeight: 205.0723
MdlNumber: MFCD00794287
Smiles: CC(=O)c1sccc1Br
Complexity: 126
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 2.3
CatalogNumber:
AF60205
ChemicalName:
2-Acetyl-3-bromothiophene
CasNumber:
42877-08-7
MolecularFormula:
C6H5BrOS
MolecularWeight:
205.0723
MdlNumber:
MFCD00794287
Smiles:
CC(=O)c1sccc1Br
Complexity:
126
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: ClC(=O)Cc1ccc(cc1)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
ClC(=O)Cc1ccc(cc1)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1cc(S(=O)C)c(cc1OC)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cc(S(=O)C)c(cc1OC)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__