AV18239
1251582-36-1 | Ethyl 5-bromo-3-((ethoxycarbonyl)amino)benzofuran-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AV18239
ChemicalName
Ethyl 5-bromo-3-((ethoxycarbonyl)amino)benzofuran-2-carboxylate
CasNumber
1251582-36-1
MolecularFormula
C14H14BrNO5
MolecularWeight
356.1687
MdlNumber
MFCD30185146
Smiles
CCOC(=O)Nc1c(oc2c1cc(Br)cc2)C(=O)OCC
Complexity
392
Covalently-bondedUnitCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
6
Xlogp3
4.1
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CatalogNumber: AV18239
ChemicalName: Ethyl 5-bromo-3-((ethoxycarbonyl)amino)benzofuran-2-carboxylate
CasNumber: 1251582-36-1
MolecularFormula: C14H14BrNO5
MolecularWeight: 356.1687
MdlNumber: MFCD30185146
Smiles: CCOC(=O)Nc1c(oc2c1cc(Br)cc2)C(=O)OCC
Complexity: 392
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 6
Xlogp3: 4.1
CatalogNumber:
AV18239
ChemicalName:
Ethyl 5-bromo-3-((ethoxycarbonyl)amino)benzofuran-2-carboxylate
CasNumber:
1251582-36-1
MolecularFormula:
C14H14BrNO5
MolecularWeight:
356.1687
MdlNumber:
MFCD30185146
Smiles:
CCOC(=O)Nc1c(oc2c1cc(Br)cc2)C(=O)OCC
Complexity:
392
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
6
Xlogp3:
4.1
CatalogNumber: AV18240
ChemicalName: 2-(1-(tert-Butoxycarbonyl)pyrrolidin-2-yl)thiazole-4-carboxylic acid
CasNumber: 1824349-18-9
MolecularFormula: C13H18N2O4S
MolecularWeight: 298.358
MdlNumber: MFCD24532481
Smiles: O=C(N1CCCC1c1scc(n1)C(=O)O)OC(C)(C)C
Complexity: 396
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 2.1
CatalogNumber:
AV18240
ChemicalName:
2-(1-(tert-Butoxycarbonyl)pyrrolidin-2-yl)thiazole-4-carboxylic acid
CasNumber:
1824349-18-9
MolecularFormula:
C13H18N2O4S
MolecularWeight:
298.358
MdlNumber:
MFCD24532481
Smiles:
O=C(N1CCCC1c1scc(n1)C(=O)O)OC(C)(C)C
Complexity:
396
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
2.1
CatalogNumber: AV18241
ChemicalName: Methyl 2-chloro-6-methoxy-3-nitrobenzoate
CasNumber: 55776-21-1
MolecularFormula: C9H8ClNO5
MolecularWeight: 245.6165
MdlNumber: MFCD30185868
Smiles: COC(=O)c1c(OC)ccc(c1Cl)[N+](=O)[O-]
Complexity: 280
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: __
RotatableBondCount: 3
Xlogp3: 2.2
CatalogNumber:
AV18241
ChemicalName:
Methyl 2-chloro-6-methoxy-3-nitrobenzoate
CasNumber:
55776-21-1
MolecularFormula:
C9H8ClNO5
MolecularWeight:
245.6165
MdlNumber:
MFCD30185868
Smiles:
COC(=O)c1c(OC)ccc(c1Cl)[N+](=O)[O-]
Complexity:
280
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
__
RotatableBondCount:
3
Xlogp3:
2.2
CatalogNumber: AV18242
ChemicalName: tert-Butyl 4-(1-benzyl-1H-imidazol-2-yl)-4-hydroxypiperidine-1-carboxylate
CasNumber: 1823794-46-2
MolecularFormula: C20H27N3O3
MolecularWeight: 357.4467
MdlNumber: MFCD27997367
Smiles: O=C(N1CCC(CC1)(O)c1nccn1Cc1ccccc1)OC(C)(C)C
Complexity: 477
Covalently-bondedUnitCount: 1
HeavyAtomCount: 26
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 5
Xlogp3: 2
CatalogNumber:
AV18242
ChemicalName:
tert-Butyl 4-(1-benzyl-1H-imidazol-2-yl)-4-hydroxypiperidine-1-carboxylate
CasNumber:
1823794-46-2
MolecularFormula:
C20H27N3O3
MolecularWeight:
357.4467
MdlNumber:
MFCD27997367
Smiles:
O=C(N1CCC(CC1)(O)c1nccn1Cc1ccccc1)OC(C)(C)C
Complexity:
477
Covalently-bondedUnitCount:
1
HeavyAtomCount:
26
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
5
Xlogp3:
2