AG19754
478258-61-6 | Methyl 2-amino-4-t-butylthiazole-5-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AG19754
ChemicalName
Methyl 2-amino-4-t-butylthiazole-5-carboxylate
CasNumber
478258-61-6
MolecularFormula
C9H14N2O2S
MolecularWeight
214.2847
MdlNumber
MFCD02082348
Smiles
COC(=O)c1sc(nc1C(C)(C)C)N
Complexity
227
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
2.5
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CatalogNumber: AG19754
ChemicalName: Methyl 2-amino-4-t-butylthiazole-5-carboxylate
CasNumber: 478258-61-6
MolecularFormula: C9H14N2O2S
MolecularWeight: 214.2847
MdlNumber: MFCD02082348
Smiles: COC(=O)c1sc(nc1C(C)(C)C)N
Complexity: 227
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.5
CatalogNumber:
AG19754
ChemicalName:
Methyl 2-amino-4-t-butylthiazole-5-carboxylate
CasNumber:
478258-61-6
MolecularFormula:
C9H14N2O2S
MolecularWeight:
214.2847
MdlNumber:
MFCD02082348
Smiles:
COC(=O)c1sc(nc1C(C)(C)C)N
Complexity:
227
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.5
CatalogNumber: AG19755
ChemicalName: 4-(5-Bromo-3-nitropyridin-2-yl)morpholine
CasNumber: 505052-64-2
MolecularFormula: C9H10BrN3O3
MolecularWeight: 288.098
MdlNumber: MFCD02736520
Smiles: Brc1cnc(c(c1)[N+](=O)[O-])N1CCOCC1
Complexity: 255
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 1.5
CatalogNumber:
AG19755
ChemicalName:
4-(5-Bromo-3-nitropyridin-2-yl)morpholine
CasNumber:
505052-64-2
MolecularFormula:
C9H10BrN3O3
MolecularWeight:
288.098
MdlNumber:
MFCD02736520
Smiles:
Brc1cnc(c(c1)[N+](=O)[O-])N1CCOCC1
Complexity:
255
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
1.5
CatalogNumber: AG19756
ChemicalName: 4-(4-Chlorophenyl)-1H-1,2,4-triazol-5(4H)-one
CasNumber: 5097-86-9
MolecularFormula: C8H6ClN3O
MolecularWeight: 195.6057
MdlNumber: MFCD11053882
Smiles: Clc1ccc(cc1)n1cn[nH]c1=O
Complexity: 236
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.6
CatalogNumber:
AG19756
ChemicalName:
4-(4-Chlorophenyl)-1H-1,2,4-triazol-5(4H)-one
CasNumber:
5097-86-9
MolecularFormula:
C8H6ClN3O
MolecularWeight:
195.6057
MdlNumber:
MFCD11053882
Smiles:
Clc1ccc(cc1)n1cn[nH]c1=O
Complexity:
236
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.6
CatalogNumber: AG19757
ChemicalName: 3-Bromo-4-fluorobenzamide
CasNumber: 455-85-6
MolecularFormula: C7H5BrFNO
MolecularWeight: 218.02310319999995
MdlNumber: MFCD03094431
Smiles: NC(=O)c1ccc(c(c1)Br)F
Complexity: 165
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.6
CatalogNumber:
AG19757
ChemicalName:
3-Bromo-4-fluorobenzamide
CasNumber:
455-85-6
MolecularFormula:
C7H5BrFNO
MolecularWeight:
218.02310319999995
MdlNumber:
MFCD03094431
Smiles:
NC(=O)c1ccc(c(c1)Br)F
Complexity:
165
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.6