AI50497
442910-26-1 | 3-(Chloromethyl)-N,N-dimethylbenzamide
Manufacturer: A2B Chem
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CatalogNumber
AI50497
ChemicalName
3-(Chloromethyl)-N,N-dimethylbenzamide
CasNumber
442910-26-1
MolecularFormula
C10H12ClNO
MolecularWeight
197.6614
MdlNumber
MFCD11208394
Smiles
ClCc1cccc(c1)C(=O)N(C)C
Complexity
182
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
1
RotatableBondCount
2
Xlogp3
2
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CatalogNumber: AI50497
ChemicalName: 3-(Chloromethyl)-N,N-dimethylbenzamide
CasNumber: 442910-26-1
MolecularFormula: C10H12ClNO
MolecularWeight: 197.6614
MdlNumber: MFCD11208394
Smiles: ClCc1cccc(c1)C(=O)N(C)C
Complexity: 182
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 1
RotatableBondCount: 2
Xlogp3: 2
CatalogNumber:
AI50497
ChemicalName:
3-(Chloromethyl)-N,N-dimethylbenzamide
CasNumber:
442910-26-1
MolecularFormula:
C10H12ClNO
MolecularWeight:
197.6614
MdlNumber:
MFCD11208394
Smiles:
ClCc1cccc(c1)C(=O)N(C)C
Complexity:
182
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
1
RotatableBondCount:
2
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1c(N)cc(cc1F)N(=O)=O
Complexity: 197
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1.1
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1c(N)cc(cc1F)N(=O)=O
Complexity:
197
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1.1
CatalogNumber: AI50499
ChemicalName: 6-(Methylamino)purine
CasNumber: 443-72-1
MolecularFormula: C6H7N5
MolecularWeight: 149.1533
MdlNumber: MFCD00075820
Smiles: CNc1ncnc2c1[nH]cn2
Complexity: 139
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
Xlogp3: 0.6
CatalogNumber:
AI50499
ChemicalName:
6-(Methylamino)purine
CasNumber:
443-72-1
MolecularFormula:
C6H7N5
MolecularWeight:
149.1533
MdlNumber:
MFCD00075820
Smiles:
CNc1ncnc2c1[nH]cn2
Complexity:
139
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
Xlogp3:
0.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Oc1c(Br)cc(cc1Br)C1(OS(=O)(=O)c2c1c(Br)c(Br)c(c2Br)Br)c1cc(Br)c(c(c1)Br)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Oc1c(Br)cc(cc1Br)C1(OS(=O)(=O)c2c1c(Br)c(Br)c(c2Br)Br)c1cc(Br)c(c(c1)Br)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__