CS-1013860
Etravirine Desamino Impurity
Manufacturer: ChemScene
CAS Number: 269055-04-1
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₂₀H₁₄BrN₅O
Molecular Weight
420.26
Synonyms
None
SMILES
N#CC1=CC=C(C=C1)NC2=NC=C(Br)C(=N2)OC=3C(=CC(C#N)=CC3C)C
Tpsa
94.62
Logp
5.1352
H Acceptors
6
H Donors
1
Rotatable Bonds
4
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 269055-04-1 | 4-((5-BROMO-2-((4-CYANOPHENYL)AMINO)-4-PYRIMIDINYL)OXY)-3,5-DIMETHYLBENZONITRILE | 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
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₁₄BrN₅O
Molecular Weight: 420.26
Synonyms: None
SMILES: N#CC1=CC=C(C=C1)NC2=NC=C(Br)C(=N2)OC=3C(=CC(C#N)=CC3C)C
Tpsa: 94.62
Logp: 5.1352
H Acceptors: 6
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₁₄BrN₅O
Molecular Weight:
420.26
Synonyms:
None
SMILES:
N#CC1=CC=C(C=C1)NC2=NC=C(Br)C(=N2)OC=3C(=CC(C#N)=CC3C)C
Tpsa:
94.62
Logp:
5.1352
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₅H₂₄BrN₇O₂
Molecular Weight: 534.41
Synonyms: None
SMILES: N#CC1=CC=C(C=C1)NC=2N=C(OC=3C(=CC(C#N)=CC3C)C)C(Br)=C(N2)N(C)CCCC(=O)N
Tpsa: 140.95
Logp: 4.8369
H Acceptors: 8
H Donors: 2
Rotatable Bonds: 9
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₅H₂₄BrN₇O₂
Molecular Weight:
534.41
Synonyms:
None
SMILES:
N#CC1=CC=C(C=C1)NC=2N=C(OC=3C(=CC(C#N)=CC3C)C)C(Br)=C(N2)N(C)CCCC(=O)N
Tpsa:
140.95
Logp:
4.8369
H Acceptors:
8
H Donors:
2
Rotatable Bonds:
9
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₂₉NO₂
Molecular Weight: 291.43
Synonyms: None
SMILES: O=C(O)C(N)CCC1=CC=C(C=C1)CCCCCCCC
Tpsa: 63.32
Logp: 3.9341
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 11
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₂₉NO₂
Molecular Weight:
291.43
Synonyms:
None
SMILES:
O=C(O)C(N)CCC1=CC=C(C=C1)CCCCCCCC
Tpsa:
63.32
Logp:
3.9341
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
11
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₇H₆₇NO₃
Molecular Weight: 573.93
Synonyms: None
SMILES: O=C(NC(CO)(CO)CCC1=CC=C(C=C1)CCCCCCCC)CCCCCCCCCCCCCCCCC
Tpsa: 69.56
Logp: 9.6233
H Acceptors: 3
H Donors: 3
Rotatable Bonds: 29
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₇H₆₇NO₃
Molecular Weight:
573.93
Synonyms:
None
SMILES:
O=C(NC(CO)(CO)CCC1=CC=C(C=C1)CCCCCCCC)CCCCCCCCCCCCCCCCC
Tpsa:
69.56
Logp:
9.6233
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
29