AB50669
843663-66-1 | Bedaquiline
Manufacturer: A2B Chem
CAS Number: 843663-66-1
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Catalog Number
AB50669
Chemical Name
Bedaquiline
Cas Number
843663-66-1
Molecular Formula
C32H31BrN2O2
Molecular Weight
555.5047
Mdl Number
MFCD22628872
Smiles
COc1nc2ccc(cc2cc1[C@H]([C@](c1cccc2c1cccc2)(CCN(C)C)O)c1ccccc1)Br
Complexity
715
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
2
Heavy Atom Count
37
Hydrogen Bond Acceptor Count
4
Hydrogen Bond Donor Count
1
Rotatable Bond Count
8
Xlogp3
7.2
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | eMolecules AstaTech / BEDAQUILINE / 0.1g / 392627741 / 43211 / 95.000 / 843663-66-1 / [null] / 555.516 / C32H31BrN2O2 | eMolecules | ₹ 13,224.15 | |
 | Medchemexpress LLC HY-14881 100mg , Bedaquiline CAS:843663-66-1 Purity:>98% | Medchemexpress LLC | ₹ 22,459.50 | |
 | eMolecules Bedaquiline | 843663-66-1 | MFCD22628872 | 100mg | eMolecules | ₹ 11,964.71 | |
 | Medchemexpress LLC HY-14881 10mg Medchemexpress, Bedaquiline CAS:843663-66-1 Purity:>98% | Medchemexpress LLC | ₹ 8,085.42 | |
 | Bedaquiline | ChemScene | ₹ 8,641.56 - ₹ 1,43,398.56 |
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Catalog Number: AB50669
Chemical Name: Bedaquiline
Cas Number: 843663-66-1
Molecular Formula: C32H31BrN2O2
Molecular Weight: 555.5047
Mdl Number: MFCD22628872
Smiles: COc1nc2ccc(cc2cc1[C@H]([C@](c1cccc2c1cccc2)(CCN(C)C)O)c1ccccc1)Br
Complexity: 715
Covalently-Bonded Unit Count: 1
Defined Atom Stereocenter Count: 2
Heavy Atom Count: 37
Hydrogen Bond Acceptor Count: 4
Hydrogen Bond Donor Count: 1
Rotatable Bond Count: 8
Xlogp3: 7.2
Catalog Number:
AB50669
Chemical Name:
Bedaquiline
Cas Number:
843663-66-1
Molecular Formula:
C32H31BrN2O2
Molecular Weight:
555.5047
Mdl Number:
MFCD22628872
Smiles:
COc1nc2ccc(cc2cc1[C@H]([C@](c1cccc2c1cccc2)(CCN(C)C)O)c1ccccc1)Br
Complexity:
715
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Heavy Atom Count:
37
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Rotatable Bond Count:
8
Xlogp3:
7.2
Catalog Number: __
Chemical Name: __
Cas Number: __
Molecular Formula: __
Molecular Weight: __
Mdl Number: __
Smiles: OCc1cccc(c1C)Br
Complexity: 105
Covalently-Bonded Unit Count: __
Defined Atom Stereocenter Count: __
Heavy Atom Count: __
Hydrogen Bond Acceptor Count: __
Hydrogen Bond Donor Count: __
Rotatable Bond Count: __
Xlogp3: 2.1
Catalog Number:
__
Chemical Name:
__
Cas Number:
__
Molecular Formula:
__
Molecular Weight:
__
Mdl Number:
__
Smiles:
OCc1cccc(c1C)Br
Complexity:
105
Covalently-Bonded Unit Count:
__
Defined Atom Stereocenter Count:
__
Heavy Atom Count:
__
Hydrogen Bond Acceptor Count:
__
Hydrogen Bond Donor Count:
__
Rotatable Bond Count:
__
Xlogp3:
2.1
Catalog Number: AB50671
Chemical Name: 2-Ethenylnaphthalene
Cas Number: 827-54-3
Molecular Formula: C12H10
Molecular Weight: 154.2078
Mdl Number: MFCD00004125
Smiles: C=Cc1ccc2c(c1)cccc2
Complexity: 159
Covalently-Bonded Unit Count: 1
Defined Atom Stereocenter Count: __
Heavy Atom Count: 12
Hydrogen Bond Acceptor Count: __
Hydrogen Bond Donor Count: __
Rotatable Bond Count: 1
Xlogp3: 4.3
Catalog Number:
AB50671
Chemical Name:
2-Ethenylnaphthalene
Cas Number:
827-54-3
Molecular Formula:
C12H10
Molecular Weight:
154.2078
Mdl Number:
MFCD00004125
Smiles:
C=Cc1ccc2c(c1)cccc2
Complexity:
159
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
__
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
__
Hydrogen Bond Donor Count:
__
Rotatable Bond Count:
1
Xlogp3:
4.3
Catalog Number: AB50672
Chemical Name: 4-(Benzyloxy)benzyl chloride
Cas Number: 836-42-0
Molecular Formula: C14H13ClO
Molecular Weight: 232.7054
Mdl Number: MFCD00000916
Smiles: ClCc1ccc(cc1)OCc1ccccc1
Complexity: __
Covalently-Bonded Unit Count: __
Defined Atom Stereocenter Count: __
Heavy Atom Count: __
Hydrogen Bond Acceptor Count: __
Hydrogen Bond Donor Count: __
Rotatable Bond Count: __
Xlogp3: __
Catalog Number:
AB50672
Chemical Name:
4-(Benzyloxy)benzyl chloride
Cas Number:
836-42-0
Molecular Formula:
C14H13ClO
Molecular Weight:
232.7054
Mdl Number:
MFCD00000916
Smiles:
ClCc1ccc(cc1)OCc1ccccc1
Complexity:
__
Covalently-Bonded Unit Count:
__
Defined Atom Stereocenter Count:
__
Heavy Atom Count:
__
Hydrogen Bond Acceptor Count:
__
Hydrogen Bond Donor Count:
__
Rotatable Bond Count:
__
Xlogp3:
__