AB49718
5457-28-3 | 3-Cyanoindole
Manufacturer: A2B Chem
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CatalogNumber
AB49718
ChemicalName
3-Cyanoindole
CasNumber
5457-28-3
MolecularFormula
C9H6N2
MolecularWeight
142.1573
MdlNumber
MFCD00022717
Smiles
N#Cc1c[nH]c2c1cccc2
NscNumber
24935
Complexity
191
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
1
HydrogenBondDonorCount
1
Xlogp3
2.3
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CatalogNumber: AB49718
ChemicalName: 3-Cyanoindole
CasNumber: 5457-28-3
MolecularFormula: C9H6N2
MolecularWeight: 142.1573
MdlNumber: MFCD00022717
Smiles: N#Cc1c[nH]c2c1cccc2
NscNumber: 24935
Complexity: 191
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
Xlogp3: 2.3
CatalogNumber:
AB49718
ChemicalName:
3-Cyanoindole
CasNumber:
5457-28-3
MolecularFormula:
C9H6N2
MolecularWeight:
142.1573
MdlNumber:
MFCD00022717
Smiles:
N#Cc1c[nH]c2c1cccc2
NscNumber:
24935
Complexity:
191
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: ClC1=NOC(C1)(C)C
NscNumber: __
Complexity: 130
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: 1.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
ClC1=NOC(C1)(C)C
NscNumber:
__
Complexity:
130
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
1.5
CatalogNumber: AB49720
ChemicalName: Methyl 2-(4,6-dichloropyrimidin-5-yl)acetate
CasNumber: 171096-33-6
MolecularFormula: C7H6Cl2N2O2
MolecularWeight: 221.0407
MdlNumber: MFCD20526414
Smiles: COC(=O)Cc1c(Cl)ncnc1Cl
NscNumber: __
Complexity: 181
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
Xlogp3: 1.9
CatalogNumber:
AB49720
ChemicalName:
Methyl 2-(4,6-dichloropyrimidin-5-yl)acetate
CasNumber:
171096-33-6
MolecularFormula:
C7H6Cl2N2O2
MolecularWeight:
221.0407
MdlNumber:
MFCD20526414
Smiles:
COC(=O)Cc1c(Cl)ncnc1Cl
NscNumber:
__
Complexity:
181
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
Xlogp3:
1.9
CatalogNumber: AB49721
ChemicalName: N-Boc-trans-1,4-cyclohexanediamine
CasNumber: 177906-48-8
MolecularFormula: C11H22N2O2
MolecularWeight: 214.3046
MdlNumber: MFCD03001719
Smiles: N[C@@H]1CC[C@H](CC1)NC(=O)OC(C)(C)C
NscNumber: __
Complexity: 215
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
Xlogp3: 1.3
CatalogNumber:
AB49721
ChemicalName:
N-Boc-trans-1,4-cyclohexanediamine
CasNumber:
177906-48-8
MolecularFormula:
C11H22N2O2
MolecularWeight:
214.3046
MdlNumber:
MFCD03001719
Smiles:
N[C@@H]1CC[C@H](CC1)NC(=O)OC(C)(C)C
NscNumber:
__
Complexity:
215
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
Xlogp3:
1.3