AB48034
850429-61-7 | Methyl 2-chlorothiazole-4-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB48034
ChemicalName
Methyl 2-chlorothiazole-4-carboxylate
CasNumber
850429-61-7
MolecularFormula
C5H4ClNO2S
MolecularWeight
177.6088
MdlNumber
MFCD06659909
Smiles
COC(=O)c1csc(n1)Cl
Complexity
144
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
4
RotatableBondCount
2
Xlogp3
2.1
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CatalogNumber: AB48034
ChemicalName: Methyl 2-chlorothiazole-4-carboxylate
CasNumber: 850429-61-7
MolecularFormula: C5H4ClNO2S
MolecularWeight: 177.6088
MdlNumber: MFCD06659909
Smiles: COC(=O)c1csc(n1)Cl
Complexity: 144
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 2.1
CatalogNumber:
AB48034
ChemicalName:
Methyl 2-chlorothiazole-4-carboxylate
CasNumber:
850429-61-7
MolecularFormula:
C5H4ClNO2S
MolecularWeight:
177.6088
MdlNumber:
MFCD06659909
Smiles:
COC(=O)c1csc(n1)Cl
Complexity:
144
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
2.1
CatalogNumber: AB48036
ChemicalName: 3-Bromo-5-methoxyphenylboronic acid
CasNumber: 849062-12-0
MolecularFormula: C7H8BBrO3
MolecularWeight: 230.8516
MdlNumber: MFCD07369759
Smiles: COc1cc(Br)cc(c1)B(O)O
Complexity: 145
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: __
CatalogNumber:
AB48036
ChemicalName:
3-Bromo-5-methoxyphenylboronic acid
CasNumber:
849062-12-0
MolecularFormula:
C7H8BBrO3
MolecularWeight:
230.8516
MdlNumber:
MFCD07369759
Smiles:
COc1cc(Br)cc(c1)B(O)O
Complexity:
145
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
__
CatalogNumber: AB48037
ChemicalName: 3-(1H-Pyrazol-3-yl)benzoic acid
CasNumber: 850375-11-0
MolecularFormula: C10H8N2O2
MolecularWeight: 188.1827
MdlNumber: MFCD03407956
Smiles: OC(=O)c1cccc(c1)c1ccn[nH]1
Complexity: 220
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 1.4
CatalogNumber:
AB48037
ChemicalName:
3-(1H-Pyrazol-3-yl)benzoic acid
CasNumber:
850375-11-0
MolecularFormula:
C10H8N2O2
MolecularWeight:
188.1827
MdlNumber:
MFCD03407956
Smiles:
OC(=O)c1cccc(c1)c1ccn[nH]1
Complexity:
220
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
1.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1nnc(c(n1)N)c1cccc(c1Cl)Cl
Complexity: 242
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1nnc(c(n1)N)c1cccc(c1Cl)Cl
Complexity:
242
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1.4