CS-1000761
Bedaquiline Fumarate Impurity 44
Manufacturer: ChemScene
CAS Number: 1228594-68-0
The price for this product is unavailable. Please request a quote
Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₃₁H₂₈BrClN₂O
Molecular Weight
559.92
Synonyms
None
SMILES
[C@@H]([C@@](CCN(C)C)(O)C=1C2=C(C=CC1)C=CC=C2)(C3=CC4=C(N=C3Cl)C=CC(Br)=C4)C5=CC=CC=C5
Tpsa
36.36
Logp
7.7753
H Acceptors
3
H Donors
1
Rotatable Bonds
7
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1228594-68-0 | | A2B Chem | -- |
SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
Compare Similar Items
Show Difference
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₁H₂₈BrClN₂O
Molecular Weight: 559.92
Synonyms: None
SMILES: [C@@H]([C@@](CCN(C)C)(O)C=1C2=C(C=CC1)C=CC=C2)(C3=CC4=C(N=C3Cl)C=CC(Br)=C4)C5=CC=CC=C5
Tpsa: 36.36
Logp: 7.7753
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₁H₂₈BrClN₂O
Molecular Weight:
559.92
Synonyms:
None
SMILES:
[C@@H]([C@@](CCN(C)C)(O)C=1C2=C(C=CC1)C=CC=C2)(C3=CC4=C(N=C3Cl)C=CC(Br)=C4)C5=CC=CC=C5
Tpsa:
36.36
Logp:
7.7753
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₀N₂O
Molecular Weight: 186.21
Synonyms: None
SMILES: N#CC1=CC=C(OCCC)C(C#N)=C1
Tpsa: 56.81
Logp: 2.21876
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₀N₂O
Molecular Weight:
186.21
Synonyms:
None
SMILES:
N#CC1=CC=C(OCCC)C(C#N)=C1
Tpsa:
56.81
Logp:
2.21876
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
3
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₂₁NO₃S
Molecular Weight: 331.43
Synonyms: None
SMILES: O=C(O)C(S)CC1=CC=C(OCCC2=NC=C(C=C2)CC)C=C1
Tpsa: 59.42
Logp: 3.191
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 8
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₂₁NO₃S
Molecular Weight:
331.43
Synonyms:
None
SMILES:
O=C(O)C(S)CC1=CC=C(OCCC2=NC=C(C=C2)CC)C=C1
Tpsa:
59.42
Logp:
3.191
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
8
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₁₅NO
Molecular Weight: 225.29
Synonyms: None
SMILES: ON1[C@H](C=2C(CC1)=CC=CC2)C3=CC=CC=C3
Tpsa: 23.47
Logp: 3.0233
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₁₅NO
Molecular Weight:
225.29
Synonyms:
None
SMILES:
ON1[C@H](C=2C(CC1)=CC=CC2)C3=CC=CC=C3
Tpsa:
23.47
Logp:
3.0233
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1