AB02852
183365-31-3 | 3-(Pyrrolidin-1-ylmethyl)aniline
Manufacturer: A2B Chem
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CatalogNumber
AB02852
ChemicalName
3-(Pyrrolidin-1-ylmethyl)aniline
CasNumber
183365-31-3
MolecularFormula
C11H16N2
MolecularWeight
176.2581
MdlNumber
MFCD04114504
Smiles
Nc1cccc(c1)CN1CCCC1
Complexity
152
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.2
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CatalogNumber: AB02852
ChemicalName: 3-(Pyrrolidin-1-ylmethyl)aniline
CasNumber: 183365-31-3
MolecularFormula: C11H16N2
MolecularWeight: 176.2581
MdlNumber: MFCD04114504
Smiles: Nc1cccc(c1)CN1CCCC1
Complexity: 152
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.2
CatalogNumber:
AB02852
ChemicalName:
3-(Pyrrolidin-1-ylmethyl)aniline
CasNumber:
183365-31-3
MolecularFormula:
C11H16N2
MolecularWeight:
176.2581
MdlNumber:
MFCD04114504
Smiles:
Nc1cccc(c1)CN1CCCC1
Complexity:
152
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.2
CatalogNumber: AB02855
ChemicalName: Methyl 4-chloroquinazoline-7-carboxylate
CasNumber: 183322-47-6
MolecularFormula: C10H7ClN2O2
MolecularWeight: 222.62777999999994
MdlNumber: MFCD08448151
Smiles: COC(=O)c1ccc2c(c1)ncnc2Cl
Complexity: 250
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: 2.4
CatalogNumber:
AB02855
ChemicalName:
Methyl 4-chloroquinazoline-7-carboxylate
CasNumber:
183322-47-6
MolecularFormula:
C10H7ClN2O2
MolecularWeight:
222.62777999999994
MdlNumber:
MFCD08448151
Smiles:
COC(=O)c1ccc2c(c1)ncnc2Cl
Complexity:
250
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
2.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1cc2c(ncnc2cc1OC)Nc1cccc(c1)Br.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cc2c(ncnc2cc1OC)Nc1cccc(c1)Br.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: ClCCOc1cc2c(Cl)ncnc2cc1OCCCl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
ClCCOc1cc2c(Cl)ncnc2cc1OCCCl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__