AE81805
16019-34-4 | 7-Benzyl-4-chloro-7h-pyrrolo[2,3-d]pyrimidine
Manufacturer: A2B Chem
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CatalogNumber
AE81805
ChemicalName
7-Benzyl-4-chloro-7h-pyrrolo[2,3-d]pyrimidine
CasNumber
16019-34-4
MolecularFormula
C13H10ClN3
MolecularWeight
243.6916
MdlNumber
MFCD09953011
Smiles
Clc1ncnc2c1ccn2Cc1ccccc1
Complexity
255
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
2
RotatableBondCount
2
Xlogp3
3.2
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CatalogNumber: AE81805
ChemicalName: 7-Benzyl-4-chloro-7h-pyrrolo[2,3-d]pyrimidine
CasNumber: 16019-34-4
MolecularFormula: C13H10ClN3
MolecularWeight: 243.6916
MdlNumber: MFCD09953011
Smiles: Clc1ncnc2c1ccn2Cc1ccccc1
Complexity: 255
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 3.2
CatalogNumber:
AE81805
ChemicalName:
7-Benzyl-4-chloro-7h-pyrrolo[2,3-d]pyrimidine
CasNumber:
16019-34-4
MolecularFormula:
C13H10ClN3
MolecularWeight:
243.6916
MdlNumber:
MFCD09953011
Smiles:
Clc1ncnc2c1ccn2Cc1ccccc1
Complexity:
255
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
3.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCNC(=O)CSc1nnc(s1)S
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCNC(=O)CSc1nnc(s1)S
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AE81807
ChemicalName: Methyl 3,5-difluoro-4-hydroxybenzoate
CasNumber: 170572-47-1
MolecularFormula: C8H6F2O3
MolecularWeight: 188.1282
MdlNumber: MFCD12406862
Smiles: COC(=O)c1cc(F)c(c(c1)F)O
Complexity: 186
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
RotatableBondCount: 2
Xlogp3: 1.8
CatalogNumber:
AE81807
ChemicalName:
Methyl 3,5-difluoro-4-hydroxybenzoate
CasNumber:
170572-47-1
MolecularFormula:
C8H6F2O3
MolecularWeight:
188.1282
MdlNumber:
MFCD12406862
Smiles:
COC(=O)c1cc(F)c(c(c1)F)O
Complexity:
186
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
RotatableBondCount:
2
Xlogp3:
1.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=O)C(CC1=CC=CC=C1)C=O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(=O)C(CC1=CC=CC=C1)C=O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__