AG33041

448190-81-6 | Methyl 3-amino-4-(cyclopentylamino)benzoate

Manufacturer: A2B Chem

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CatalogNumber

AG33041

ChemicalName

Methyl 3-amino-4-(cyclopentylamino)benzoate

CasNumber

448190-81-6

MolecularFormula

C13H18N2O2

MolecularWeight

234.2942

MdlNumber

MFCD13343641

Smiles

COC(=O)c1ccc(c(c1)N)NC1CCCC1

Complexity

264

Covalently-bondedUnitCount

1

HeavyAtomCount

17

HydrogenBondAcceptorCount

4

HydrogenBondDonorCount

2

RotatableBondCount

4

Xlogp3

2.3

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A2B Chem

AG33041

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CatalogNumber:
AG33041

ChemicalName:
Methyl 3-amino-4-(cyclopentylamino)benzoate

CasNumber:
448190-81-6

MolecularFormula:
C13H18N2O2

MolecularWeight:
234.2942

MdlNumber:
MFCD13343641

Smiles:
COC(=O)c1ccc(c(c1)N)NC1CCCC1

Complexity:
264

Covalently-bondedUnitCount:
1

HeavyAtomCount:
17

HydrogenBondAcceptorCount:
4

HydrogenBondDonorCount:
2

RotatableBondCount:
4

Xlogp3:
2.3

Img

A2B Chem

AG33042

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CatalogNumber:
AG33042

ChemicalName:
N-Methyl-4-nitro-2-(trifluoromethyl)aniline

CasNumber:
54672-10-5

MolecularFormula:
C8H7F3N2O2

MolecularWeight:
220.1486

MdlNumber:
MFCD00100091

Smiles:
CNc1ccc(cc1C(F)(F)F)[N+](=O)[O-]

Complexity:
239

Covalently-bondedUnitCount:
1

HeavyAtomCount:
15

HydrogenBondAcceptorCount:
6

HydrogenBondDonorCount:
1

RotatableBondCount:
1

Xlogp3:
2.6

Img

A2B Chem

AG33043

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CatalogNumber:
AG33043

ChemicalName:
2-Morpholino-5-nitrobenzotrifluoride

CasNumber:
54672-11-6

MolecularFormula:
C11H11F3N2O3

MolecularWeight:
276.2118

MdlNumber:
MFCD00100093

Smiles:
[O-][N+](=O)c1ccc(c(c1)C(F)(F)F)N1CCOCC1

Complexity:
326

Covalently-bondedUnitCount:
1

HeavyAtomCount:
19

HydrogenBondAcceptorCount:
7

HydrogenBondDonorCount:
__

RotatableBondCount:
1

Xlogp3:
2.4

Img

A2B Chem

AG33044

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
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MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
CC(NC(=O)C1CCCC1)C

Complexity:
__

Covalently-bondedUnitCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
__