AB45377
903129-71-5 | tert-Butyl 2,4-dichloro-5H-pyrrolo[3,4-d]pyrimidine-6(7H)-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB45377
ChemicalName
tert-Butyl 2,4-dichloro-5H-pyrrolo[3,4-d]pyrimidine-6(7H)-carboxylate
CasNumber
903129-71-5
MolecularFormula
C11H13Cl2N3O2
MolecularWeight
290.1458
MdlNumber
MFCD08273919
Smiles
Clc1nc2CN(Cc2c(n1)Cl)C(=O)OC(C)(C)C
Complexity
335
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
4
RotatableBondCount
2
Xlogp3
2.4
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CatalogNumber: AB45377
ChemicalName: tert-Butyl 2,4-dichloro-5H-pyrrolo[3,4-d]pyrimidine-6(7H)-carboxylate
CasNumber: 903129-71-5
MolecularFormula: C11H13Cl2N3O2
MolecularWeight: 290.1458
MdlNumber: MFCD08273919
Smiles: Clc1nc2CN(Cc2c(n1)Cl)C(=O)OC(C)(C)C
Complexity: 335
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 2.4
CatalogNumber:
AB45377
ChemicalName:
tert-Butyl 2,4-dichloro-5H-pyrrolo[3,4-d]pyrimidine-6(7H)-carboxylate
CasNumber:
903129-71-5
MolecularFormula:
C11H13Cl2N3O2
MolecularWeight:
290.1458
MdlNumber:
MFCD08273919
Smiles:
Clc1nc2CN(Cc2c(n1)Cl)C(=O)OC(C)(C)C
Complexity:
335
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
2.4
CatalogNumber: AB45378
ChemicalName: 6-Bromobenzothiazole
CasNumber: 53218-26-1
MolecularFormula: C7H4BrNS
MolecularWeight: 214.0824
MdlNumber: MFCD04115372
Smiles: Brc1ccc2c(c1)scn2
Complexity: 131
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
RotatableBondCount: __
Xlogp3: 2.7
CatalogNumber:
AB45378
ChemicalName:
6-Bromobenzothiazole
CasNumber:
53218-26-1
MolecularFormula:
C7H4BrNS
MolecularWeight:
214.0824
MdlNumber:
MFCD04115372
Smiles:
Brc1ccc2c(c1)scn2
Complexity:
131
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
RotatableBondCount:
__
Xlogp3:
2.7
CatalogNumber: AB45379
ChemicalName: 6-Bromo-1-hexanol
CasNumber: 4286-55-9
MolecularFormula: C6H13BrO
MolecularWeight: 181.0708
MdlNumber: MFCD00002983
Smiles: OCCCCCCBr
Complexity: 39.5
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 1
RotatableBondCount: 5
Xlogp3: 1.7
CatalogNumber:
AB45379
ChemicalName:
6-Bromo-1-hexanol
CasNumber:
4286-55-9
MolecularFormula:
C6H13BrO
MolecularWeight:
181.0708
MdlNumber:
MFCD00002983
Smiles:
OCCCCCCBr
Complexity:
39.5
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
1
RotatableBondCount:
5
Xlogp3:
1.7
CatalogNumber: AB45380
ChemicalName: 6-Bromo-1H-indazole
CasNumber: 79762-54-2
MolecularFormula: C7H5BrN2
MolecularWeight: 197.032
MdlNumber: MFCD03265457
Smiles: Brc1ccc2c(c1)[nH]nc2
Complexity: 129
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 1
RotatableBondCount: __
Xlogp3: 2.9
CatalogNumber:
AB45380
ChemicalName:
6-Bromo-1H-indazole
CasNumber:
79762-54-2
MolecularFormula:
C7H5BrN2
MolecularWeight:
197.032
MdlNumber:
MFCD03265457
Smiles:
Brc1ccc2c(c1)[nH]nc2
Complexity:
129
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
1
RotatableBondCount:
__
Xlogp3:
2.9