CS-0914376
1-(2,6-difluorobenzyl)-5-((dimethylamino)methyl)-3-(6-methoxypyridazin-3-yl)-6-(4-nitrophenyl)thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Manufacturer: ChemScene
CAS Number: 1589503-96-7
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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
C₂₇H₂₂F₂N₆O₅S
Molecular Weight
580.56
Synonyms
None
SMILES
O=C1C2=C(SC(C=3C=CC(=CC3)N(=O)=O)=C2CN(C)C)N(C(=O)N1C4=NN=C(OC)C=C4)CC=5C(F)=CC=CC5F
Tpsa
125.39
Logp
3.9758
H Acceptors
11
H Donors
0
Rotatable Bonds
8
Related Products
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: C₂₇H₂₂F₂N₆O₅S
Molecular Weight: 580.56
Synonyms: None
SMILES: O=C1C2=C(SC(C=3C=CC(=CC3)N(=O)=O)=C2CN(C)C)N(C(=O)N1C4=NN=C(OC)C=C4)CC=5C(F)=CC=CC5F
Tpsa: 125.39
Logp: 3.9758
H Acceptors: 11
H Donors: 0
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:
C₂₇H₂₂F₂N₆O₅S
Molecular Weight:
580.56
Synonyms:
None
SMILES:
O=C1C2=C(SC(C=3C=CC(=CC3)N(=O)=O)=C2CN(C)C)N(C(=O)N1C4=NN=C(OC)C=C4)CC=5C(F)=CC=CC5F
Tpsa:
125.39
Logp:
3.9758
H Acceptors:
11
H Donors:
0
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: C₂₈H₂₉F₂N₇O₄S
Molecular Weight: 597.64
Synonyms: None
SMILES: O=C(NOC)NC=1C=CC(=CC1)C=2SC(NCC=3C(F)=CC=CC3F)=C(C(=O)NC4=NN=C(OC)C=C4)C2CN(C)C
Tpsa: 129.74
Logp: 5.1008
H Acceptors: 9
H Donors: 4
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:
C₂₈H₂₉F₂N₇O₄S
Molecular Weight:
597.64
Synonyms:
None
SMILES:
O=C(NOC)NC=1C=CC(=CC1)C=2SC(NCC=3C(F)=CC=CC3F)=C(C(=O)NC4=NN=C(OC)C=C4)C2CN(C)C
Tpsa:
129.74
Logp:
5.1008
H Acceptors:
9
H Donors:
4
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: C₂₇H₂₂F₂N₆O₅S
Molecular Weight: 580.56
Synonyms: None
SMILES: O=C(NOC)NC=1C=CC(=CC1)C=2SC3=C(C(=O)N(C(=O)N3CC=4C(F)=CC=CC4F)C5=NN=C(OC)C=C5)C2C
Tpsa: 129.37
Logp: 3.99732
H Acceptors: 10
H Donors: 2
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:
C₂₇H₂₂F₂N₆O₅S
Molecular Weight:
580.56
Synonyms:
None
SMILES:
O=C(NOC)NC=1C=CC(=CC1)C=2SC3=C(C(=O)N(C(=O)N3CC=4C(F)=CC=CC4F)C5=NN=C(OC)C=C5)C2C
Tpsa:
129.37
Logp:
3.99732
H Acceptors:
10
H Donors:
2
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: C₂₈H₂₅F₂N₇O₅S
Molecular Weight: 609.60
Synonyms: None
SMILES: O=C(NOC)NC=1C=CC(=CC1)C=2SC3=C(C(=O)N(C(=O)N3CC=4C(F)=CC=CC4F)C5=NN=C(OC)C=C5)C2CNC
Tpsa: 141.4
Logp: 3.4083
H Acceptors: 11
H Donors: 3
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:
C₂₈H₂₅F₂N₇O₅S
Molecular Weight:
609.60
Synonyms:
None
SMILES:
O=C(NOC)NC=1C=CC(=CC1)C=2SC3=C(C(=O)N(C(=O)N3CC=4C(F)=CC=CC4F)C5=NN=C(OC)C=C5)C2CNC
Tpsa:
141.4
Logp:
3.4083
H Acceptors:
11
H Donors:
3
Rotatable Bonds:
9