AI41543
1845698-44-3 | 2-Bromo-5-acetamido-4-methylbenzoic acid
Manufacturer: A2B Chem
CAS Number: 1845698-44-3
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Catalog Number
AI41543
Chemical Name
2-Bromo-5-acetamido-4-methylbenzoic acid
Cas Number
1845698-44-3
Molecular Formula
C10H10BrNO3
Molecular Weight
272.0953
Mdl Number
MFCD28515414
Smiles
CC(=O)Nc1cc(C(=O)O)c(cc1C)Br
Complexity
269
Covalently-Bonded Unit Count
1
Heavy Atom Count
15
Hydrogen Bond Acceptor Count
3
Hydrogen Bond Donor Count
2
Rotatable Bond Count
2
Xlogp3
1.7
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 5-Acetamido-2-bromo-4-methylbenzoic acid | ChemScene | ₹ 95,052.00 - ₹ 2,07,904.00 |
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Catalog Number: AI41543
Chemical Name: 2-Bromo-5-acetamido-4-methylbenzoic acid
Cas Number: 1845698-44-3
Molecular Formula: C10H10BrNO3
Molecular Weight: 272.0953
Mdl Number: MFCD28515414
Smiles: CC(=O)Nc1cc(C(=O)O)c(cc1C)Br
Complexity: 269
Covalently-Bonded Unit Count: 1
Heavy Atom Count: 15
Hydrogen Bond Acceptor Count: 3
Hydrogen Bond Donor Count: 2
Rotatable Bond Count: 2
Xlogp3: 1.7
Catalog Number:
AI41543
Chemical Name:
2-Bromo-5-acetamido-4-methylbenzoic acid
Cas Number:
1845698-44-3
Molecular Formula:
C10H10BrNO3
Molecular Weight:
272.0953
Mdl Number:
MFCD28515414
Smiles:
CC(=O)Nc1cc(C(=O)O)c(cc1C)Br
Complexity:
269
Covalently-Bonded Unit Count:
1
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Rotatable Bond Count:
2
Xlogp3:
1.7
Catalog Number: AI41544
Chemical Name: tert-Butyl 4-(2-bromo-5-chlorophenyl)piperazine-1-carboxylate
Cas Number: 1845698-46-5
Molecular Formula: C15H20BrClN2O2
Molecular Weight: 375.6885
Mdl Number: MFCD28515372
Smiles: Clc1ccc(c(c1)N1CCN(CC1)C(=O)OC(C)(C)C)Br
Complexity: 367
Covalently-Bonded Unit Count: 1
Heavy Atom Count: 21
Hydrogen Bond Acceptor Count: 3
Hydrogen Bond Donor Count: __
Rotatable Bond Count: 3
Xlogp3: 4
Catalog Number:
AI41544
Chemical Name:
tert-Butyl 4-(2-bromo-5-chlorophenyl)piperazine-1-carboxylate
Cas Number:
1845698-46-5
Molecular Formula:
C15H20BrClN2O2
Molecular Weight:
375.6885
Mdl Number:
MFCD28515372
Smiles:
Clc1ccc(c(c1)N1CCN(CC1)C(=O)OC(C)(C)C)Br
Complexity:
367
Covalently-Bonded Unit Count:
1
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
__
Rotatable Bond Count:
3
Xlogp3:
4
Catalog Number: __
Chemical Name: __
Cas Number: __
Molecular Formula: __
Molecular Weight: __
Mdl Number: __
Smiles: COCCCN(S(=O)(=O)C)c1ccccc1[N+](=O)[O-]
Complexity: 387
Covalently-Bonded Unit Count: __
Heavy Atom Count: __
Hydrogen Bond Acceptor Count: __
Hydrogen Bond Donor Count: __
Rotatable Bond Count: __
Xlogp3: 1.1
Catalog Number:
__
Chemical Name:
__
Cas Number:
__
Molecular Formula:
__
Molecular Weight:
__
Mdl Number:
__
Smiles:
COCCCN(S(=O)(=O)C)c1ccccc1[N+](=O)[O-]
Complexity:
387
Covalently-Bonded Unit Count:
__
Heavy Atom Count:
__
Hydrogen Bond Acceptor Count:
__
Hydrogen Bond Donor Count:
__
Rotatable Bond Count:
__
Xlogp3:
1.1
Catalog Number: AI41546
Chemical Name: Ethyl 7-bromo-2-methyl-1-propyl-1,3-benzodiazole-5-carboxylate
Cas Number: 1845698-62-5
Molecular Formula: C14H17BrN2O2
Molecular Weight: 325.201
Mdl Number: MFCD28962777
Smiles: CCOC(=O)c1cc(Br)c2c(c1)nc(n2CCC)C
Complexity: 327
Covalently-Bonded Unit Count: 1
Heavy Atom Count: 19
Hydrogen Bond Acceptor Count: 3
Hydrogen Bond Donor Count: __
Rotatable Bond Count: 5
Xlogp3: 3.6
Catalog Number:
AI41546
Chemical Name:
Ethyl 7-bromo-2-methyl-1-propyl-1,3-benzodiazole-5-carboxylate
Cas Number:
1845698-62-5
Molecular Formula:
C14H17BrN2O2
Molecular Weight:
325.201
Mdl Number:
MFCD28962777
Smiles:
CCOC(=O)c1cc(Br)c2c(c1)nc(n2CCC)C
Complexity:
327
Covalently-Bonded Unit Count:
1
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
__
Rotatable Bond Count:
5
Xlogp3:
3.6