AV18630
21344-92-3 | N-Allyl-4-(2-chlorophenyl)thiazol-2-amine
Manufacturer: A2B Chem
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CatalogNumber
AV18630
ChemicalName
N-Allyl-4-(2-chlorophenyl)thiazol-2-amine
CasNumber
21344-92-3
MolecularFormula
C12H11ClN2S
MolecularWeight
250.7471
MdlNumber
MFCD09370409
Smiles
C=CCN=c1scc([nH]1)c1ccccc1Cl
Complexity
237
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
4.2
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CatalogNumber: AV18630
ChemicalName: N-Allyl-4-(2-chlorophenyl)thiazol-2-amine
CasNumber: 21344-92-3
MolecularFormula: C12H11ClN2S
MolecularWeight: 250.7471
MdlNumber: MFCD09370409
Smiles: C=CCN=c1scc([nH]1)c1ccccc1Cl
Complexity: 237
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 4.2
CatalogNumber:
AV18630
ChemicalName:
N-Allyl-4-(2-chlorophenyl)thiazol-2-amine
CasNumber:
21344-92-3
MolecularFormula:
C12H11ClN2S
MolecularWeight:
250.7471
MdlNumber:
MFCD09370409
Smiles:
C=CCN=c1scc([nH]1)c1ccccc1Cl
Complexity:
237
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
4.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C#C[C@@]1(OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H](O[C@H]1n1ccc(=O)[nH]c1=O)COC(=O)c1ccccc1
Complexity: 1160
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3.7
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C#C[C@@]1(OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H](O[C@H]1n1ccc(=O)[nH]c1=O)COC(=O)c1ccccc1
Complexity:
1160
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3.7
CatalogNumber: AV18633
ChemicalName: 2-(2-Methoxypyridin-4-yl)ethanamine dihydrochloride
CasNumber: 170026-02-5
MolecularFormula: C8H14Cl2N2O
MolecularWeight: 225.1156
MdlNumber: MFCD28991725
Smiles: NCCc1ccnc(c1)OC.Cl.Cl
Complexity: 108
Covalently-bondedUnitCount: 3
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 3
RotatableBondCount: 3
Xlogp3: __
CatalogNumber:
AV18633
ChemicalName:
2-(2-Methoxypyridin-4-yl)ethanamine dihydrochloride
CasNumber:
170026-02-5
MolecularFormula:
C8H14Cl2N2O
MolecularWeight:
225.1156
MdlNumber:
MFCD28991725
Smiles:
NCCc1ccnc(c1)OC.Cl.Cl
Complexity:
108
Covalently-bondedUnitCount:
3
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
3
RotatableBondCount:
3
Xlogp3:
__
CatalogNumber: AV18634
ChemicalName: Ethyl 5-((tert-butoxycarbonyl)amino)-6-methylnicotinate
CasNumber: 936801-42-2
MolecularFormula: C14H20N2O4
MolecularWeight: 280.3196
MdlNumber: MFCD18256584
Smiles: CCOC(=O)c1cnc(c(c1)NC(=O)OC(C)(C)C)C
Complexity: 352
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 6
Xlogp3: 2
CatalogNumber:
AV18634
ChemicalName:
Ethyl 5-((tert-butoxycarbonyl)amino)-6-methylnicotinate
CasNumber:
936801-42-2
MolecularFormula:
C14H20N2O4
MolecularWeight:
280.3196
MdlNumber:
MFCD18256584
Smiles:
CCOC(=O)c1cnc(c(c1)NC(=O)OC(C)(C)C)C
Complexity:
352
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
6
Xlogp3:
2