기본 정보
- CAS
200066-88-2- 표준 SMILES
O=c1ccn([C@@H]2O[C@](CF)(COCc3ccccc3)[C@@H](OCc3ccccc3)[C@H]2O)c(=O)[nH]1- InChIKey
WJCNIYZWARRXQP-JTOYRKQZSA-N- 분자식
- C24H25FN2O6
- 평균 분자량
- 456.5 g/mol
이름 및 식별자
- 우선 이름
- 1-[(2R,3R,4S,5R)-4-Benzyloxy-5-(benzyloxymethyl)-5-(fluoromethyl)-3-hydroxy-tetrahydrofuran-2-yl]pyrimidine-2,4-dione
- IUPAC
- 1-[(2R,3R,4S,5R)-5-(fluoromethyl)-3-hydroxy-4-phenylmethoxy-5-(phenylmethoxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
- 영어명
- Uridine, 4'-C-(fluoromethyl)-3',5'-bis-O-(phenylmethyl)-
- 분자식
- C24H25FN2O6
- 분자량
- 456.46
이름 및 동의어
200066-88-21-[(2R,3R,4S,5R)-4-Benzyloxy-5-(benzyloxymethyl)-5-(fluoromethyl)-3-hydroxy-tetrahydrofuran-2-yl]pyrimidine-2,4-dioneMFCD32862080Uridine, 4'-C-(fluoromethyl)-3',5'-bis-O-(phenylmethyl)-1-((2R,3R,4S,5R)-4-(Benzyloxy)-5-((benzyloxy)methyl)-5-(fluoromethyl)-3-hydroxytetrahydrofuran-2-yl)pyrimidine-2,4(1H,3H)-dione1-[(2R,3R,4S,5R)-4-(BENZYLOXY)-5-[(BENZYLOXY)METHYL]-5-(FLUOROMETHYL)-3-HYDROXYOXOLAN-2-YL]-1,2,3,4-TETRAHYDROPYRIMIDINE-2,4-DIONE1-[(2R,3R,4S,5R)-5-(Fluoromethyl)-3-hydroxy-4-phenylmethoxy-5-(phenylmethoxymethyl)oxolan-2-yl]pyrimidine-2,4-dione1-[(2R,3R,4S,5R)-4-(Benzyloxy)-5-[(benzyloxy)methyl]-5-(fluoromethyl)-3-hydroxytetrahydrofuran-2-yl]pyrimidine-2,4(1H,3H)-dioneSCHEMBL18049482C24H25FN2O6AS-79376SY323160
이름 더 보기
Uridine, 4'-C-(fluoromethyl)-3',5'-bis-O-(phenylmethyl)- (9CI)1-[(2R,3R,4S,5R)-4-benzyloxy-5-(benzyloxymethyl)-5-(fluoromethyl)-3-hydroxy-tetrahydrofuran-2-yl]pyrimidine-2,4-dione - 97%
CS-0310094D79454F7194041-((2R,3R,4S,5R)-4-(Benzyloxy)-5-((benzyloxy)methyl)-5-(fluoromethyl)-3-hydroxytetrahydrofuran-2-yl)pyrimidine-2,4(1H,3H)
물성
구조 계산 물성
- XLogP
- 1.4
- 극성 표면적
- 97.3 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 9
- 무거운 원자 수
- 33
- 형식 전하
- 0
- 복잡도
- 709
물리화학적 성질
- 밀도
- 1.37 · 1.37±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 9.39 · 9.39±0.10(Predicted)
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