AF32608
300586-90-7 | N-1H-Pyrrolo[2,3-c]pyridin-5-ylbenzamide
Manufacturer: A2B Chem
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CatalogNumber
AF32608
ChemicalName
N-1H-Pyrrolo[2,3-c]pyridin-5-ylbenzamide
CasNumber
300586-90-7
MolecularFormula
C14H11N3O
MolecularWeight
237.2566
MdlNumber
MFCD00572806
Smiles
O=C(c1ccccc1)Nc1ncc2c(c1)cc[nH]2
Complexity
301
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
2.1
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CatalogNumber: AF32608
ChemicalName: N-1H-Pyrrolo[2,3-c]pyridin-5-ylbenzamide
CasNumber: 300586-90-7
MolecularFormula: C14H11N3O
MolecularWeight: 237.2566
MdlNumber: MFCD00572806
Smiles: O=C(c1ccccc1)Nc1ncc2c(c1)cc[nH]2
Complexity: 301
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 2.1
CatalogNumber:
AF32608
ChemicalName:
N-1H-Pyrrolo[2,3-c]pyridin-5-ylbenzamide
CasNumber:
300586-90-7
MolecularFormula:
C14H11N3O
MolecularWeight:
237.2566
MdlNumber:
MFCD00572806
Smiles:
O=C(c1ccccc1)Nc1ncc2c(c1)cc[nH]2
Complexity:
301
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NCCCC[C@@H](C(=O)N1CCN(CC1)c1ccncc1)NC(=O)[C@H](NC(=O)N1CCC(CC1)N1Cc2ccccc2NC1=O)Cc1cc(Br)c(c(c1)Br)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
NCCCC[C@@H](C(=O)N1CCN(CC1)c1ccncc1)NC(=O)[C@H](NC(=O)N1CCC(CC1)N1Cc2ccccc2NC1=O)Cc1cc(Br)c(c(c1)Br)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AF32610
ChemicalName: Paradol
CasNumber: 27113-22-0
MolecularFormula: C17H26O3
MolecularWeight: 278.3865
MdlNumber: MFCD01736103
Smiles: CCCCCCCC(=O)CCc1ccc(c(c1)OC)O
Complexity: 265
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 10
Xlogp3: 3.8
CatalogNumber:
AF32610
ChemicalName:
Paradol
CasNumber:
27113-22-0
MolecularFormula:
C17H26O3
MolecularWeight:
278.3865
MdlNumber:
MFCD01736103
Smiles:
CCCCCCCC(=O)CCc1ccc(c(c1)OC)O
Complexity:
265
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
10
Xlogp3:
3.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(C[C@H](C(=O)O)ON1C(=O)c2c(C1=O)cccc2)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(C[C@H](C(=O)O)ON1C(=O)c2c(C1=O)cccc2)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__