AI30246
1330765-06-4 | (6,7-Dihydro-5h-pyrrolo[1,2-a]imidazol-5-yl)-methanol
Manufacturer: A2B Chem
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CatalogNumber
AI30246
ChemicalName
(6,7-Dihydro-5h-pyrrolo[1,2-a]imidazol-5-yl)-methanol
CasNumber
1330765-06-4
MolecularFormula
C7H10N2O
MolecularWeight
138.1671
MdlNumber
MFCD20230577
Smiles
OCC1CCc2n1ccn2
Complexity
129
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
1
UndefinedAtomStereocenterCount
1
Xlogp3
-0.3
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CatalogNumber: AI30246
ChemicalName: (6,7-Dihydro-5h-pyrrolo[1,2-a]imidazol-5-yl)-methanol
CasNumber: 1330765-06-4
MolecularFormula: C7H10N2O
MolecularWeight: 138.1671
MdlNumber: MFCD20230577
Smiles: OCC1CCc2n1ccn2
Complexity: 129
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
UndefinedAtomStereocenterCount: 1
Xlogp3: -0.3
CatalogNumber:
AI30246
ChemicalName:
(6,7-Dihydro-5h-pyrrolo[1,2-a]imidazol-5-yl)-methanol
CasNumber:
1330765-06-4
MolecularFormula:
C7H10N2O
MolecularWeight:
138.1671
MdlNumber:
MFCD20230577
Smiles:
OCC1CCc2n1ccn2
Complexity:
129
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
1
Xlogp3:
-0.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCc1nn(c2c1CN(CC2)C(=O)OC(C)(C)C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCc1nn(c2c1CN(CC2)C(=O)OC(C)(C)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AI30248
ChemicalName: tert-Butyl 3-(6-bromoimidazo[1,5-a]pyridin-1-yl)azetidine-1-carboxylate
CasNumber: 1330765-09-7
MolecularFormula: C15H18BrN3O2
MolecularWeight: 352.2263
MdlNumber: MFCD20231136
Smiles: Brc1ccc2n(c1)cnc2C1CN(C1)C(=O)OC(C)(C)C
Complexity: 406
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 3
UndefinedAtomStereocenterCount: __
Xlogp3: 3.3
CatalogNumber:
AI30248
ChemicalName:
tert-Butyl 3-(6-bromoimidazo[1,5-a]pyridin-1-yl)azetidine-1-carboxylate
CasNumber:
1330765-09-7
MolecularFormula:
C15H18BrN3O2
MolecularWeight:
352.2263
MdlNumber:
MFCD20231136
Smiles:
Brc1ccc2n(c1)cnc2C1CN(C1)C(=O)OC(C)(C)C
Complexity:
406
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
__
Xlogp3:
3.3
CatalogNumber: AI30249
ChemicalName: tert-Butyl 3-(hydroxymethyl)-1-isopropyl-4,5-dihydro-1h-pyrazolo[3,4-c]pyridine-6(7h)-carboxylate
CasNumber: 1330765-10-0
MolecularFormula: C15H25N3O3
MolecularWeight: 295.3773
MdlNumber: MFCD20231198
Smiles: OCc1nn(c2c1CCN(C2)C(=O)OC(C)(C)C)C(C)C
Complexity: 381
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 4
UndefinedAtomStereocenterCount: __
Xlogp3: 0.8
CatalogNumber:
AI30249
ChemicalName:
tert-Butyl 3-(hydroxymethyl)-1-isopropyl-4,5-dihydro-1h-pyrazolo[3,4-c]pyridine-6(7h)-carboxylate
CasNumber:
1330765-10-0
MolecularFormula:
C15H25N3O3
MolecularWeight:
295.3773
MdlNumber:
MFCD20231198
Smiles:
OCc1nn(c2c1CCN(C2)C(=O)OC(C)(C)C)C(C)C
Complexity:
381
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
__
Xlogp3:
0.8