AV18279
1003959-62-3 | 2-Ethyl-1,3-diazaspiro[4.4]non-1-en-4-one
Manufacturer: A2B Chem
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CatalogNumber
AV18279
ChemicalName
2-Ethyl-1,3-diazaspiro[4.4]non-1-en-4-one
CasNumber
1003959-62-3
MolecularFormula
C9H14N2O
MolecularWeight
166.2203
MdlNumber
MFCD24615238
Smiles
CCC1=NC(=O)C2(N1)CCCC2
Complexity
239
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
0.7
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CatalogNumber: AV18279
ChemicalName: 2-Ethyl-1,3-diazaspiro[4.4]non-1-en-4-one
CasNumber: 1003959-62-3
MolecularFormula: C9H14N2O
MolecularWeight: 166.2203
MdlNumber: MFCD24615238
Smiles: CCC1=NC(=O)C2(N1)CCCC2
Complexity: 239
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 0.7
CatalogNumber:
AV18279
ChemicalName:
2-Ethyl-1,3-diazaspiro[4.4]non-1-en-4-one
CasNumber:
1003959-62-3
MolecularFormula:
C9H14N2O
MolecularWeight:
166.2203
MdlNumber:
MFCD24615238
Smiles:
CCC1=NC(=O)C2(N1)CCCC2
Complexity:
239
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
0.7
CatalogNumber: AV18280
ChemicalName: 4,4'-((2-Cyclopropyl-1,4-phenylene)bis(ethyne-2,1-diyl))bis(butylbenzene)
CasNumber: 1282582-89-1
MolecularFormula: C33H34
MolecularWeight: 430.6231
MdlNumber: MFCD28991980
Smiles: CCCCc1ccc(cc1)C#Cc1ccc(c(c1)C1CC1)C#Cc1ccc(cc1)CCCC
Complexity: 698
Covalently-bondedUnitCount: 1
HeavyAtomCount: 33
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: 11
Xlogp3: 10.6
CatalogNumber:
AV18280
ChemicalName:
4,4'-((2-Cyclopropyl-1,4-phenylene)bis(ethyne-2,1-diyl))bis(butylbenzene)
CasNumber:
1282582-89-1
MolecularFormula:
C33H34
MolecularWeight:
430.6231
MdlNumber:
MFCD28991980
Smiles:
CCCCc1ccc(cc1)C#Cc1ccc(c(c1)C1CC1)C#Cc1ccc(cc1)CCCC
Complexity:
698
Covalently-bondedUnitCount:
1
HeavyAtomCount:
33
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
11
Xlogp3:
10.6
CatalogNumber: AV18281
ChemicalName: N-Isopropyl-1H-indole-5-carboxamide
CasNumber: 953029-91-9
MolecularFormula: C12H14N2O
MolecularWeight: 202.2524
MdlNumber: MFCD13177550
Smiles: CC(NC(=O)c1ccc2c(c1)cc[nH]2)C
Complexity: 240
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 2.1
CatalogNumber:
AV18281
ChemicalName:
N-Isopropyl-1H-indole-5-carboxamide
CasNumber:
953029-91-9
MolecularFormula:
C12H14N2O
MolecularWeight:
202.2524
MdlNumber:
MFCD13177550
Smiles:
CC(NC(=O)c1ccc2c(c1)cc[nH]2)C
Complexity:
240
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cl/C=C(Oc1ccccc1)/Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cl/C=C(Oc1ccccc1)/Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__