AI49747
39887-30-4 | 4-Iodo-N-propylbenzamide
Manufacturer: A2B Chem
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CatalogNumber
AI49747
ChemicalName
4-Iodo-N-propylbenzamide
CasNumber
39887-30-4
MolecularFormula
C10H12INO
MolecularWeight
289.1128
MdlNumber
MFCD04208252
Smiles
CCCNC(=O)c1ccc(cc1)I
Complexity
164
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
1
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
2.6
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CatalogNumber: AI49747
ChemicalName: 4-Iodo-N-propylbenzamide
CasNumber: 39887-30-4
MolecularFormula: C10H12INO
MolecularWeight: 289.1128
MdlNumber: MFCD04208252
Smiles: CCCNC(=O)c1ccc(cc1)I
Complexity: 164
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.6
CatalogNumber:
AI49747
ChemicalName:
4-Iodo-N-propylbenzamide
CasNumber:
39887-30-4
MolecularFormula:
C10H12INO
MolecularWeight:
289.1128
MdlNumber:
MFCD04208252
Smiles:
CCCNC(=O)c1ccc(cc1)I
Complexity:
164
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(c1ccc(cc1)Cl)NC1CC1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(c1ccc(cc1)Cl)NC1CC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AI49749
ChemicalName: 2-(2-Chloropyridin-5-yl)acetic acid
CasNumber: 39891-13-9
MolecularFormula: C7H6ClNO2
MolecularWeight: 171.581
MdlNumber: MFCD01863172
Smiles: OC(=O)Cc1ccc(nc1)Cl
Complexity: 151
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.3
CatalogNumber:
AI49749
ChemicalName:
2-(2-Chloropyridin-5-yl)acetic acid
CasNumber:
39891-13-9
MolecularFormula:
C7H6ClNO2
MolecularWeight:
171.581
MdlNumber:
MFCD01863172
Smiles:
OC(=O)Cc1ccc(nc1)Cl
Complexity:
151
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.3
CatalogNumber: AI49751
ChemicalName: 4-Fluoroindole-2-carboxylic acid
CasNumber: 399-68-8
MolecularFormula: C9H6FNO2
MolecularWeight: 179.1478
MdlNumber: MFCD02664471
Smiles: OC(=O)c1cc2c([nH]1)cccc2F
Complexity: 222
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 2.4
CatalogNumber:
AI49751
ChemicalName:
4-Fluoroindole-2-carboxylic acid
CasNumber:
399-68-8
MolecularFormula:
C9H6FNO2
MolecularWeight:
179.1478
MdlNumber:
MFCD02664471
Smiles:
OC(=O)c1cc2c([nH]1)cccc2F
Complexity:
222
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
2.4